data_1zzp_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 1zzp _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 34' ' ' ILE . . . . . 0.453 HG21 ' HB2' ' A' ' 77' ' ' TYR . 49.6 mm . . . . . 0 N--CA 1.457 -0.115 0 CA-C-O 121.185 0.517 . . . . 1.08 111.918 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.4 p -131.75 -172.44 2.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 1.13 109.898 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.505 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -66.08 -33.55 76.04 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.541 -0.464 . . . . 1.55 110.073 179.404 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.78 -45.9 94.77 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 0.18 111.316 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.4 t -67.91 -39.97 82.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.657 0.741 . . . . 1.93 109.525 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -43.28 95.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.619 -1.173 . . . . 1.05 110.852 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.477 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 23.8 mt -60.98 -48.8 80.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.763 0.316 . . . . 1.08 110.543 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.69 -33.25 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.24 110.366 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.44 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 46.0 m -76.87 -35.41 57.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.96 111.47 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.503 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -71.8 -33.39 68.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.971 0.415 . . . . 1.08 110.838 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -77.22 -48.88 16.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.02 -0.536 . . . . 1.52 110.776 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.93 -46.99 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.139 -0.482 . . . . 1.07 110.974 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.48 HD11 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.91 -38.44 79.58 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.306 -0.406 . . . . 1.04 110.247 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.48 ' N ' HD11 ' A' ' 46' ' ' LEU . 7.8 t -55.52 -35.68 65.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.004 0.431 . . . . 1.15 109.847 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.18 -34.21 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.826 -0.624 . . . . 1.95 109.834 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.32 -35.4 73.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.232 -0.655 . . . . 1.03 109.232 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.493 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.5 mt -72.11 -33.71 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.701 -0.852 . . . . 1.02 108.701 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -74.37 -12.82 60.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.041 -0.982 . . . . 1.01 109.6 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 . . . . . 0 N--CA 1.456 -0.172 0 CA-C-N 115.364 -0.834 . . . . 3.48 110.98 -179.992 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 . . . . . 0 N--CA 1.457 -0.077 0 N-CA-C 109.887 -0.412 . . . . 1.87 109.887 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.5 m -76.9 -3.22 37.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.754 -0.657 . . . . 2.05 110.848 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.73 -53.73 5.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.094 0.473 . . . . 1.12 109.891 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.493 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -69.64 -28.97 39.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 1.13 109.701 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.593 HD21 ' NE2' ' A' ' 105' ' ' GLN . 0.6 OUTLIER -72.23 -53.42 12.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.841 -1.072 . . . . 1.13 110.98 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.37 -49.37 78.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.302 0.572 . . . . 2.32 109.894 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.24 -27.32 67.12 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.368 -0.975 . . . . 1.01 108.368 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -61.75 -47.54 89.71 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.746 -1.116 . . . . 0.56 112.582 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.439 ' HD2' HD13 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -65.81 -41.36 91.97 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.574 0.226 . . . . 1.57 111.224 -179.535 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 72' ' ' SER . 19.7 m-80 -58.42 -43.16 88.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.91 0.386 . . . . 0.53 110.953 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.503 HD21 ' N ' ' A' ' 43' ' ' THR . 3.2 tm? -64.7 -50.21 67.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.977 -0.556 . . . . 2.06 111.133 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -56.52 -33.27 65.88 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.679 -0.86 . . . . 1.31 108.679 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 70.6 m -65.17 -50.6 65.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.012 -0.994 . . . . 1.45 111.001 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.41 ' HB3' HG22 ' A' ' 34' ' ' ILE . 11.5 m-85 -62.17 -43.64 98.39 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.363 -0.535 . . . . 0.46 111.639 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -51.19 70.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.263 -0.426 . . . . 1.54 110.896 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.36 -37.79 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 112.527 0.566 . . . . 1.13 112.527 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -86.4 -10.27 54.64 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.056 0.455 . . . . 1.51 110.866 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.453 ' HB2' HG21 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -91.91 -23.55 19.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.787 -0.642 . . . . 0.8 111.778 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.453 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.0 OUTLIER -72.81 -11.44 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.949 0.404 . . . . 1.54 111.574 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -71.9 -3.61 23.47 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 1.31 109.681 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -110.64 1.97 18.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.45 -0.795 . . . . 1.93 111.459 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.527 ' CG2' ' HB2' ' A' ' 87' ' ' LYS . 23.3 mm -66.31 115.78 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 120.528 -0.469 . . . . 1.39 110.172 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.525 ' O ' ' HG3' ' A' ' 84' ' ' MET . 0.2 OUTLIER -84.67 -29.11 25.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 121.087 0.47 . . . . 2.55 110.099 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.665 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 15.0 mm100 -46.52 -47.08 19.55 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.26 -0.882 . . . . 3.3 113.101 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 43.3 mtm 81.91 -91.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.763 0.653 . . . . 3.25 112.763 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -64.75 0.92 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.886 0.374 . . . . 3.42 111.736 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.665 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -114.61 -17.97 11.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.067 -0.716 . . . . 2.49 109.067 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.527 ' HB2' ' CG2' ' A' ' 81' ' ' ILE . 0.6 OUTLIER -58.77 -35.65 73.11 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.173 -0.921 . . . . 2.88 109.289 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.469 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 71.1 m-85 -56.98 -44.25 82.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.574 -0.739 . . . . 3.08 110.026 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -53.77 -61.82 2.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 1.17 112.085 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.459 ' O ' HG13 ' A' ' 94' ' ' ILE . 66.9 t80 -63.23 -45.59 90.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.39 111.559 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.2 OUTLIER -58.15 -52.44 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 3.9 111.723 -178.139 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 11.0 pt-20 -54.94 -36.46 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.192 -0.299 . . . . 2.58 110.192 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.06 -40.03 88.09 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.665 0.745 . . . . 0.96 109.123 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 90' ' ' PHE . 32.9 mt -61.81 -41.2 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.174 -0.921 . . . . 1.09 109.018 178.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.619 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.51 -39.11 79.18 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.589 -1.187 . . . . 0.33 109.292 179.422 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.619 ' HD2' HD21 ' A' ' 95' ' ' ASN . 1.3 mptm? -54.4 -47.5 72.67 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.752 -0.462 . . . . 2.3 109.752 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.562 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 33.7 tp -59.95 -32.27 70.64 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.631 -0.427 . . . . 1.29 110.197 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -58.64 -60.14 4.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.144 -0.48 . . . . 1.87 110.736 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.437 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 0.9 OUTLIER -73.57 -10.22 59.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 2.12 111.474 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.447 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.9 -47.86 19.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.723 -0.843 . . . . 0.42 108.723 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 8.2 mt -66.42 -31.92 72.97 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.234 -0.894 . . . . 1.23 108.659 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.437 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 87.1 mtt180 -54.69 -55.76 26.41 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.092 -0.958 . . . . 2.63 110.764 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -71.89 -18.99 62.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.979 0.418 . . . . 2.32 110.495 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.459 HD11 ' CE2' ' A' ' 121' ' ' PHE . 32.9 tp -79.53 -18.18 52.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.941 -0.572 . . . . 1.08 111.225 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.593 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.217 0 CA-C-N 116.483 -0.326 . . . . 2.04 111.322 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.5 m-30 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.733 0.272 . . . . 0.61 111.733 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' SER . . . . . 0.469 ' HB2' ' HZ2' ' A' ' 123' ' ' LYS . 31.0 m -71.64 -14.28 62.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.938 -0.305 . . . . 1.78 110.605 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.469 ' HZ2' ' HB2' ' A' ' 122' ' ' SER . 0.1 OUTLIER -69.64 -44.21 71.06 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.198 -0.668 . . . . 3.05 109.198 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.483 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.1 OUTLIER -59.61 -25.44 64.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.376 -0.829 . . . . 1.13 108.771 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tp -73.88 -48.19 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.134 -0.939 . . . . 1.99 110.636 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.5 t -63.91 -35.82 81.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.131 -0.486 . . . . 1.87 111.123 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.416 ' O ' HG13 ' A' ' 131' ' ' ILE . 65.6 m -65.58 -46.74 78.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.541 . . . . 1.66 111.91 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.89 -55.43 23.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 1.29 111.537 -178.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -50.61 -40.68 53.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.764 -0.653 . . . . 3.15 111.017 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.5 -55.31 36.64 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.837 -0.62 . . . . 2.1 112.061 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.418 ' H ' HG13 ' A' ' 131' ' ' ILE . 0.1 OUTLIER -50.24 -56.14 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 120.735 0.303 . . . . 1.11 111.157 -178.857 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 30.7 t -56.61 -47.6 79.27 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.262 -0.426 . . . . 1.44 110.758 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -50.18 -26.73 4.91 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.922 -0.581 . . . . 0.37 112.28 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.1 mt -86.29 -51.21 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 113.131 0.789 . . . . 1.08 113.131 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.505 HG21 ' HG3' ' A' ' 36' ' ' LYS . 1.4 p -53.98 -47.56 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 113.897 1.073 . . . . 1.01 113.897 -177.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 . . . . . 0 C--N 1.326 -0.453 0 C-N-CA 120.636 -0.426 . . . . 0.91 111.709 -178.363 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.635 ' HA ' HG12 ' A' ' 38' ' ' VAL . 47.4 mm . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 121.241 0.543 . . . . 1.08 111.814 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.479 ' O ' HG13 ' A' ' 38' ' ' VAL . 81.2 p -123.45 -160.27 0.9 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.427 -0.806 . . . . 1.13 109.179 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.715 ' HD3' HG22 ' A' ' 135' ' ' VAL . 6.5 ttpt -69.78 -39.97 76.3 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.206 -0.597 . . . . 1.55 109.426 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -52.18 -49.6 49.5 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.251 -0.886 . . . . 0.18 112.861 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -65.82 -38.67 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.606 0.717 . . . . 1.93 109.565 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.483 ' N ' HG11 ' A' ' 38' ' ' VAL . 1.3 t -62.64 -38.11 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.578 -1.192 . . . . 1.05 111.181 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.403 ' HA ' ' HG1' ' A' ' 43' ' ' THR . 20.0 mt -68.18 -51.41 46.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.062 -0.347 . . . . 1.08 110.062 178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.48 -31.02 21.97 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.315 -0.624 . . . . 0.24 109.315 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.2 m -73.96 -44.33 55.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.301 -0.863 . . . . 0.96 110.7 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.436 HG22 HD11 ' A' ' 70' ' ' LEU . 3.6 p -60.2 -37.7 81.04 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 120.865 0.364 . . . . 1.08 111.049 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.46 -52.91 27.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 1.52 111.29 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.12 -47.11 34.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 1.07 111.572 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.638 HD23 HD21 ' A' ' 70' ' ' LEU . 4.0 pp -74.91 -40.26 60.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.45 -0.341 . . . . 1.04 110.742 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.418 ' N ' HD13 ' A' ' 46' ' ' LEU . 44.1 t -55.46 -39.96 71.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.048 0.451 . . . . 1.15 110.276 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -70.3 -35.01 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 1.95 109.948 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.04 81.38 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.702 -0.481 . . . . 1.03 109.702 178.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.604 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.0 mt -70.72 -30.18 41.04 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 N-CA-C 108.785 -0.82 . . . . 1.02 108.785 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -79.15 -13.8 59.5 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.117 -0.947 . . . . 1.01 109.649 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.375 -0.829 . . . . 3.48 111.439 -179.612 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 109.861 -0.422 . . . . 1.87 109.861 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -78.08 -10.88 59.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.729 -0.669 . . . . 2.05 110.27 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.28 -45.94 24.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 1.12 110.206 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.604 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.13 -29.55 21.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 1.13 109.896 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.606 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.2 tm? -74.35 -51.24 15.67 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.992 -1.004 . . . . 1.13 111.18 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.31 -49.47 71.62 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.154 0.502 . . . . 2.32 109.799 179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.96 -27.41 67.44 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.258 -1.015 . . . . 1.01 108.258 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -65.08 -46.42 88.63 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.795 -1.093 . . . . 0.56 112.253 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.28 -43.94 98.04 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.847 0.356 . . . . 1.57 110.559 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -58.44 -41.95 86.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.53 111.033 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.638 HD21 HD23 ' A' ' 46' ' ' LEU . 12.9 tp -61.52 -47.69 84.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.2 -0.455 . . . . 2.06 110.432 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.471 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 10.5 t80 -57.94 -35.42 71.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.933 -0.576 . . . . 1.31 110.228 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 53.1 p -80.23 -18.62 48.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 1.45 112.399 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -80.31 -44.44 19.55 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.326 -0.99 . . . . 0.46 108.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.454 ' HA ' ' HB3' ' A' ' 77' ' ' TYR . 3.8 m -68.99 -27.08 65.37 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.502 -0.772 . . . . 1.54 109.118 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.5 OUTLIER -66.14 -37.78 80.51 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.615 -0.721 . . . . 1.13 110.801 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.5 t -91.06 -9.66 44.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.996 0.426 . . . . 1.51 110.07 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.454 ' HB3' ' HA ' ' A' ' 74' ' ' CYS . 0.2 OUTLIER -90.77 -28.35 18.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.634 -0.712 . . . . 0.8 111.454 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.455 ' HA ' HG12 ' A' ' 81' ' ' ILE . 3.4 m -66.1 -11.39 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.96 0.409 . . . . 1.54 111.663 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -71.05 -2.9 17.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 1.31 110.811 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 57.4 p -119.19 3.56 11.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.977 -0.556 . . . . 1.93 111.924 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.69 HG21 HD22 ' A' ' 86' ' ' ASN . 11.9 mm -55.22 -33.06 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 111.956 0.354 . . . . 1.39 111.956 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.492 ' C ' ' NE2' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 61.96 -66.65 0.07 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.565 0.95 . . . . 2.55 113.565 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.515 ' O ' ' N ' ' A' ' 85' ' ' ARG . 9.5 mt-30 -46.03 -9.33 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.97 1.1 . . . . 3.3 113.97 -177.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.538 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 7.5 ptt? 48.43 -69.92 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.566 1.321 . . . . 3.25 114.566 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 83' ' ' GLN . 34.0 ttm180 -48.97 -40.87 32.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.568 0.622 . . . . 3.42 110.729 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.69 HD22 HG21 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -73.3 -28.2 61.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.692 -0.686 . . . . 2.49 110.631 179.237 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -56.72 -37.05 70.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.027 -0.533 . . . . 2.88 111.021 -179.336 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -57.03 -48.5 78.35 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.578 -0.449 . . . . 3.08 110.067 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.44 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.91 -65.6 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.955 -0.566 . . . . 1.17 111.875 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.551 ' O ' HG13 ' A' ' 94' ' ' ILE . 68.0 t80 -62.83 -47.4 83.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.535 0.569 . . . . 0.39 112.535 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.8 OUTLIER -57.99 -56.52 20.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.686 -0.233 . . . . 3.9 111.32 -177.446 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.7 pt-20 -52.38 -36.18 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.886 -0.413 . . . . 2.58 109.886 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.45 -38.91 88.92 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.366 -0.605 . . . . 0.96 109.366 178.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -62.26 -40.93 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 N-CA-C 108.724 -0.843 . . . . 1.09 108.724 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.589 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.65 -42.53 88.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.444 -1.253 . . . . 0.33 109.225 179.238 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.589 ' HD2' HD21 ' A' ' 95' ' ' ASN . 1.1 mptm? -52.92 -40.94 63.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.501 -0.555 . . . . 2.3 109.501 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.585 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 15.5 tp -65.3 -35.79 82.07 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.888 -0.596 . . . . 1.29 110.238 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -53.63 -61.37 2.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.076 0.465 . . . . 1.87 110.383 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 0.4 OUTLIER -63.35 -40.62 97.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.669 -0.696 . . . . 2.12 111.156 179.054 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.489 HD21 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -49.45 -45.56 46.8 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.957 0.408 . . . . 0.42 110.051 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 4.8 mt -68.27 -39.55 82.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.792 -0.64 . . . . 1.23 109.537 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 47.0 mtp180 -54.59 -48.48 72.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.237 -0.892 . . . . 2.63 111.307 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.84 -21.35 55.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.087 0.47 . . . . 2.32 110.19 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.582 HD23 HD23 ' A' ' 64' ' ' LEU . 22.2 tp -77.79 -11.92 59.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.632 -0.713 . . . . 1.08 110.916 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.606 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 116.049 -0.523 . . . . 2.04 111.146 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.436 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 111.871 0.323 . . . . 0.61 111.871 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 58.7 m -66.45 -15.26 63.2 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.837 -0.345 . . . . 1.78 110.221 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.41 -40.11 67.42 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.123 -0.695 . . . . 3.05 109.123 178.752 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 124' ' ' LEU . 1.7 tp -65.5 -15.97 63.2 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.895 -0.78 . . . . 1.13 108.895 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.81 -48.18 13.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.173 -0.922 . . . . 1.99 110.15 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.9 p -73.54 -29.36 62.4 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 1.87 110.741 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.0 t -69.32 -49.13 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.883 -0.599 . . . . 1.66 110.691 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -42.15 92.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 115.372 -0.831 . . . . 1.29 110.832 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -64.35 -33.9 76.9 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.878 -0.601 . . . . 3.15 110.404 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -59.59 -46.53 88.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.761 -0.654 . . . . 2.1 110.751 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -57.25 -55.65 19.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.923 0.392 . . . . 1.11 110.464 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' HG11 ' A' ' 135' ' ' VAL . 1.4 t -53.68 -42.74 68.27 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.911 -0.586 . . . . 1.44 110.809 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.77 -37.89 77.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.998 -0.546 . . . . 0.37 112.066 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 72.8 mt -64.46 -53.1 46.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 112.057 0.392 . . . . 1.08 112.057 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.715 HG22 ' HD3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.05 -40.8 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 N-CA-C 112.793 0.664 . . . . 1.01 112.793 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 111.935 0.346 . . . . 0.91 111.935 -178.832 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.642 ' HA ' HG13 ' A' ' 38' ' ' VAL . 47.1 mm . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.335 0.588 . . . . 1.08 112.152 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.486 ' O ' HG11 ' A' ' 38' ' ' VAL . 72.0 p -124.02 -160.35 0.92 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.319 -0.855 . . . . 1.13 109.342 178.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.567 ' HG3' HG12 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -75.5 -27.14 58.67 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.467 -0.568 . . . . 1.55 109.467 178.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.64 -46.58 93.43 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.46 -0.791 . . . . 0.18 111.832 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.642 HG13 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -68.88 -36.03 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.688 0.756 . . . . 1.93 109.29 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.423 ' N ' HG12 ' A' ' 38' ' ' VAL . 1.5 t -63.26 -43.66 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.467 -1.242 . . . . 1.05 110.764 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.511 HD13 ' HE3' ' A' ' 36' ' ' LYS . 26.4 mt -61.73 -51.12 69.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.798 0.332 . . . . 1.08 110.254 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -54.64 -30.09 54.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.24 110.166 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.478 ' HB2' HD22 ' A' ' 70' ' ' LEU . 70.2 m -79.38 -36.79 38.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.624 -0.716 . . . . 0.96 111.456 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.487 ' N ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -71.33 -26.93 63.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.177 0.513 . . . . 1.08 109.802 178.698 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -80.85 -45.74 16.39 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.592 -0.731 . . . . 1.52 109.956 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.91 -47.26 52.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.928 -0.578 . . . . 1.07 111.043 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.512 HD11 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -72.66 -39.28 67.25 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.726 -0.39 . . . . 1.04 110.056 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.512 ' N ' HD11 ' A' ' 46' ' ' LEU . 51.9 t -54.2 -42.25 69.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.128 -0.487 . . . . 1.15 110.276 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -38.4 81.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.77 -0.65 . . . . 1.95 109.682 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.25 -28.97 63.42 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.107 -0.497 . . . . 1.03 109.803 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -75.88 -39.37 37.78 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 108.888 -0.782 . . . . 1.02 108.888 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t -73.13 -10.04 59.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.273 -0.876 . . . . 1.01 109.595 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.159 -0.928 . . . . 3.48 110.437 179.432 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 121.09 0.471 . . . . 1.87 109.755 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -75.08 -10.4 59.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.618 -0.719 . . . . 2.05 110.473 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.92 -48.41 14.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.044 -0.526 . . . . 1.12 110.098 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.455 ' CG2' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -73.17 -35.79 48.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.277 -0.638 . . . . 1.13 109.277 178.441 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.646 HD22 ' NE2' ' A' ' 105' ' ' GLN . 2.0 tm? -64.15 -54.9 26.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.037 -0.983 . . . . 1.13 110.689 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.08 -48.88 78.23 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.258 -0.428 . . . . 2.32 111.726 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.2 -25.1 65.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.066 -0.516 . . . . 1.01 110.893 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.418 ' HA2' ' CD2' ' A' ' 46' ' ' LEU . . . -83.55 -30.15 30.78 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.176 -1.011 . . . . 0.56 112.402 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.609 ' HD2' HD11 ' A' ' 101' ' ' LEU . 15.7 mmmt -63.99 -35.23 80.01 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.977 -1.12 . . . . 1.57 107.977 177.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -70.0 -43.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.479 -1.237 . . . . 0.53 109.9 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 43' ' ' THR . 3.4 tm? -59.08 -48.1 82.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.298 -0.864 . . . . 2.06 110.147 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.536 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 10.7 t80 -61.14 -33.25 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.908 -0.587 . . . . 1.31 109.64 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 t -73.29 -26.85 61.24 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.673 -0.694 . . . . 1.45 112.03 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -81.61 -43.55 18.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 119.725 -0.79 . . . . 0.46 109.452 -178.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.4 m -64.31 -43.8 93.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.704 -0.68 . . . . 1.54 109.672 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.536 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.93 -39.75 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.955 -0.566 . . . . 1.13 111.995 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.4 t -86.73 -11.21 51.78 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.997 -0.681 . . . . 1.51 110.441 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.441 ' HB2' HG23 ' A' ' 34' ' ' ILE . 0.6 OUTLIER -90.68 -23.96 20.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.755 -0.657 . . . . 0.8 112.146 -179.395 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.459 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.6 m -70.28 -8.4 10.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.182 0.515 . . . . 1.54 111.221 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -74.77 -0.99 20.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.861 -0.609 . . . . 1.31 110.357 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 80.2 p -114.05 4.79 15.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.962 -0.563 . . . . 1.93 111.325 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 78' ' ' VAL . 25.0 mm -70.4 92.88 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 116.474 -0.33 . . . . 1.39 111.197 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.56 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -59.81 -34.76 73.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.781 -0.822 . . . . 2.55 108.781 178.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.616 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 1.6 mp0 -60.82 172.14 1.02 Allowed 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 114.905 -1.043 . . . . 3.3 109.969 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.4 ' C ' ' H ' ' A' ' 86' ' ' ASN . 4.9 ptm -144.06 -43.77 0.26 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.326 -0.397 . . . . 3.25 111.335 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -81.99 9.69 7.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.665 0.745 . . . . 3.42 109.045 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.616 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -126.89 -32.51 2.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.587 -1.188 . . . . 2.49 110.041 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -50.65 -44.63 57.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.387 -0.824 . . . . 2.88 111.067 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.52 ' N ' ' HD2' ' A' ' 87' ' ' LYS . 2.2 p90 -56.89 -46.8 81.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.4 0.619 . . . . 3.08 110.219 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.486 ' N ' ' CG ' ' A' ' 88' ' ' PHE . . . -52.77 -59.7 4.17 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.949 -1.023 . . . . 1.17 112.193 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.514 ' O ' HG13 ' A' ' 94' ' ' ILE . 68.8 t80 -66.13 -48.09 71.96 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.263 0.468 . . . . 0.39 112.263 -179.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -56.61 -52.92 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.462 -0.335 . . . . 3.9 110.795 -177.728 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.5 pt-20 -55.52 -36.87 67.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 2.58 110.382 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.2 -39.25 85.88 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.433 0.635 . . . . 0.96 109.731 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 90' ' ' PHE . 21.2 mt -62.63 -40.97 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.404 0 CA-C-N 115.357 -0.838 . . . . 1.09 108.806 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.579 ' ND2' ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.51 -40.83 83.97 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.497 -1.229 . . . . 0.33 109.186 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.579 ' HD2' ' ND2' ' A' ' 95' ' ' ASN . 11.0 mptt -51.95 -49.89 62.26 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.374 -0.375 . . . . 2.3 110.133 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.518 ' HG ' HD12 ' A' ' 101' ' ' LEU . 30.7 tp -58.44 -32.25 68.53 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 116.079 -0.51 . . . . 1.29 110.606 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.59 -60.08 4.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.373 -0.376 . . . . 1.87 110.495 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -72.59 -10.04 59.31 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.119 -0.491 . . . . 2.12 111.587 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.46 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.72 -43.95 21.68 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.37 -0.974 . . . . 0.42 108.37 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.609 HD11 ' HD2' ' A' ' 68' ' ' LYS . 10.5 mt -68.11 -33.19 74.05 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.053 -0.976 . . . . 1.23 108.45 178.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -54.95 -55.55 29.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.854 -1.066 . . . . 2.63 110.534 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -71.76 -21.95 61.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.001 0.429 . . . . 2.32 110.575 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.558 HD23 HD21 ' A' ' 64' ' ' LEU . 29.3 tp -77.77 -17.99 56.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 1.08 111.339 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.646 ' NE2' HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.322 -0.399 . . . . 2.04 111.234 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.517 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.162 0 N-CA-C 111.951 0.352 . . . . 0.61 111.951 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 43.9 m -66.82 -15.91 63.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.917 -0.401 . . . . 1.78 109.917 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 123' ' ' LYS . 3.0 mppt? -70.89 -44.38 66.42 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.715 -0.846 . . . . 3.05 108.715 178.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.475 ' O ' HD11 ' A' ' 124' ' ' LEU . 1.4 tp -60.23 -22.1 62.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.463 -0.789 . . . . 1.13 108.945 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -48.81 29.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.258 -0.883 . . . . 1.99 109.872 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.1 m -67.12 -31.68 72.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.703 -0.681 . . . . 1.87 110.667 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.478 ' O ' HG13 ' A' ' 131' ' ' ILE . 68.6 m -66.98 -41.73 86.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 1.66 111.218 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.473 HG11 ' HB ' ' A' ' 43' ' ' THR . 26.2 t -63.42 -56.16 18.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.13 -0.486 . . . . 1.29 111.074 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.0 mmtt -52.67 -36.48 57.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.56 -0.746 . . . . 3.15 111.341 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.407 ' O ' HG13 ' A' ' 134' ' ' ILE . 40.3 tt0 -62.5 -51.61 66.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.106 -0.497 . . . . 2.1 112.278 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.498 ' H ' HG13 ' A' ' 131' ' ' ILE . 1.3 mt -55.23 -55.23 17.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 C-N-CA 120.942 -0.303 . . . . 1.11 110.96 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.1 p -55.21 -45.77 75.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 1.44 111.275 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.79 -31.29 58.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.37 111.739 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.449 HG22 ' N ' ' A' ' 90' ' ' PHE . 91.1 mt -74.78 -51.25 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 112.877 0.695 . . . . 1.08 112.877 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.567 HG12 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.57 -41.62 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 112.296 0.48 . . . . 1.01 112.296 -179.056 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.309 -0.405 . . . . 0.91 111.848 -178.852 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.638 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.0 mm . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 121.361 0.601 . . . . 1.08 112.065 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.54 ' O ' HG12 ' A' ' 38' ' ' VAL . 77.5 p -129.55 -159.42 0.96 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.291 -0.868 . . . . 1.13 109.483 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.49 ' HB2' HG23 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.3 -30.86 60.49 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.384 -0.527 . . . . 1.55 109.733 178.463 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.443 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -60.85 -46.14 95.12 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.539 -0.755 . . . . 0.18 112.046 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.638 HG11 ' HA ' ' A' ' 34' ' ' ILE . 10.8 p -66.97 -39.3 83.14 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 1.93 109.522 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.445 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -63.23 -43.38 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 114.825 -1.079 . . . . 1.05 110.876 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.481 HD23 ' HG ' ' A' ' 132' ' ' SER . 36.2 mt -63.11 -46.85 85.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.71 0.29 . . . . 1.08 110.521 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.9 -32.63 67.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.966 0.412 . . . . 0.24 110.224 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.458 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 39.3 m -77.47 -35.45 53.79 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.747 -0.661 . . . . 0.96 111.371 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.469 ' OG1' ' HA ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -73.31 -26.6 61.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.509 . . . . 1.08 109.816 178.545 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -79.11 -47.26 16.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.509 -0.769 . . . . 1.52 110.161 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.51 -47.29 63.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.054 -0.521 . . . . 1.07 111.024 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.529 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.2 pp -69.97 -40.28 75.48 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.821 -0.352 . . . . 1.04 110.182 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.51 ' N ' HD13 ' A' ' 46' ' ' LEU . 53.9 t -57.31 -41.69 80.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.043 -0.526 . . . . 1.15 110.889 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mp -65.88 -39.86 91.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 1.95 110.238 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.84 -39.65 71.71 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.78 -0.452 . . . . 1.03 109.78 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -70.12 -38.5 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.228 0 N-CA-C 108.902 -0.777 . . . . 1.02 108.902 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -71.14 -14.55 62.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 1.01 109.18 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-N 115.266 -0.879 . . . . 3.48 111.137 -179.944 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.954 0.407 . . . . 1.87 110.013 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -77.61 -5.11 49.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 2.05 111.17 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.97 -48.98 10.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.973 0.416 . . . . 1.12 110.515 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.509 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -68.05 -39.48 81.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.826 -0.624 . . . . 1.13 110.258 179.334 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.602 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.1 tm? -65.02 -56.06 15.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.442 -0.799 . . . . 1.13 111.224 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.14 -44.04 95.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.342 -0.39 . . . . 2.32 111.596 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.63 -45.71 85.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.041 -0.527 . . . . 1.01 111.063 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.439 ' HA2' ' CD2' ' A' ' 46' ' ' LEU . . . -62.87 -31.36 80.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.335 -0.936 . . . . 0.56 112.578 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.494 ' HZ1' HE22 ' A' ' 105' ' ' GLN . 1.0 OUTLIER -63.07 -44.31 96.14 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.464 -0.939 . . . . 1.57 108.464 177.503 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -62.68 -38.63 91.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.61 -1.177 . . . . 0.53 110.341 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.458 ' CD2' ' HB2' ' A' ' 42' ' ' SER . 2.8 tm? -65.77 -49.97 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.472 -0.785 . . . . 2.06 111.069 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -53.6 -34.88 59.99 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.735 -0.839 . . . . 1.31 108.735 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.0 m -68.46 -49.67 58.14 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.042 -0.981 . . . . 1.45 111.444 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -57.25 -43.57 83.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.92 -0.712 . . . . 0.46 110.581 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.422 ' O ' HG13 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -60.74 -29.33 69.31 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.766 -0.652 . . . . 1.54 109.838 178.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -37.13 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.489 -0.778 . . . . 1.13 111.36 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.3 t -89.59 -9.03 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 1.51 110.977 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.454 ' HB2' HG21 ' A' ' 34' ' ' ILE . 1.6 t80 -94.63 -29.6 14.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.0 -0.545 . . . . 0.8 111.614 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.448 ' O ' HG12 ' A' ' 81' ' ' ILE . 3.6 m -61.65 -11.92 6.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.148 0.499 . . . . 1.54 111.034 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -80.19 8.67 6.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.769 -0.65 . . . . 1.31 109.877 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 58.5 m -117.53 -8.99 10.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.694 -0.685 . . . . 1.93 110.693 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.474 HG23 ' HG3' ' A' ' 87' ' ' LYS . 34.6 mm -56.91 106.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 116.106 -0.497 . . . . 1.39 110.869 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.656 HE21 ' C ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER -67.93 -48.39 66.09 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.936 0.398 . . . . 2.55 110.133 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.562 ' HB2' ' ND2' ' A' ' 86' ' ' ASN . 28.7 mt-30 -59.31 -174.55 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.77 -0.65 . . . . 3.3 109.955 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -152.46 -40.34 0.11 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.349 -0.54 . . . . 3.25 111.582 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -73.78 -1.9 21.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.642 0.734 . . . . 3.42 109.052 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.588 ' ND2' ' N ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -115.65 -25.57 7.79 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.943 -1.026 . . . . 2.49 110.611 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.588 ' N ' ' ND2' ' A' ' 86' ' ' ASN . 1.0 OUTLIER -45.47 -48.93 13.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.798 -0.637 . . . . 2.88 111.083 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -56.2 -43.0 78.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.793 -0.64 . . . . 3.08 110.75 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -55.24 -61.24 2.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.271 0.471 . . . . 1.17 112.271 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.557 ' O ' HG13 ' A' ' 94' ' ' ILE . 88.9 t80 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.195 0.442 . . . . 0.39 112.195 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.06 -55.03 31.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 3.9 110.654 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.4 pt-20 -58.55 -34.3 70.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 2.58 110.564 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -59.99 -37.99 81.29 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.494 0.664 . . . . 0.96 109.823 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.0 mt -66.11 -36.22 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 115.336 -0.847 . . . . 1.09 109.123 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.623 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -61.74 -32.09 72.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.86 -1.063 . . . . 0.33 109.22 179.115 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.623 ' HD2' HD21 ' A' ' 95' ' ' ASN . 0.7 OUTLIER -63.89 -48.67 75.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.526 -0.546 . . . . 2.3 109.526 178.581 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.559 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 23.5 tp -58.11 -33.59 69.29 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 116.165 -0.47 . . . . 1.29 109.951 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.491 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 7.5 tp10 -57.75 -59.24 5.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.892 -0.594 . . . . 1.87 110.424 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.568 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 29.3 m-80 -72.75 -9.93 59.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 2.12 111.181 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.463 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -78.41 -47.94 16.51 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 108.683 -0.858 . . . . 0.42 108.683 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 5.9 mt -65.5 -34.44 78.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.323 -0.991 . . . . 1.23 108.323 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 98.2 mtt180 -55.49 -50.03 70.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.942 -1.026 . . . . 2.63 111.256 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.75 -22.13 50.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.106 0.479 . . . . 2.32 110.136 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.547 HD23 HD23 ' A' ' 64' ' ' LEU . 42.0 tp -69.37 -17.31 63.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.721 -0.672 . . . . 1.08 110.83 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.602 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.168 0 CA-C-O 120.769 0.319 . . . . 2.04 110.517 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.443 ' HB2' HG22 ' A' ' 50' ' ' ILE . 2.0 m-30 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 112.234 0.457 . . . . 0.61 112.234 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 96.4 p -73.18 -17.15 61.4 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.702 -0.481 . . . . 1.78 109.702 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.459 ' HA ' ' HD2' ' A' ' 123' ' ' LYS . 29.8 mmmt -66.83 -52.61 41.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 109.135 -0.691 . . . . 3.05 109.135 178.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.8 OUTLIER -51.41 -27.04 9.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.001 -0.999 . . . . 1.13 109.049 177.544 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.46 -49.71 38.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.266 -0.879 . . . . 1.99 110.214 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 89.7 p -64.43 -34.26 77.78 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.903 -0.59 . . . . 1.87 111.128 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 t -62.31 -46.88 86.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 1.66 111.529 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.401 HG13 ' HB ' ' A' ' 43' ' ' THR . 53.8 t -60.87 -50.23 81.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 1.29 111.311 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -50.71 -43.82 57.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.035 -0.53 . . . . 3.15 110.92 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.407 ' O ' HG13 ' A' ' 134' ' ' ILE . 10.9 tp10 -59.26 -55.47 34.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.638 -0.71 . . . . 2.1 112.79 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -51.36 -55.07 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-O 120.826 0.346 . . . . 1.11 111.299 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.481 ' HG ' HD23 ' A' ' 40' ' ' LEU . 41.2 t -53.61 -48.4 69.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.11 -0.496 . . . . 1.44 111.048 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.87 -29.84 30.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.103 0.408 . . . . 0.37 112.103 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 130' ' ' GLU . 65.7 mt -76.8 -51.31 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 113.012 0.745 . . . . 1.08 113.012 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.49 HG23 ' HB2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -58.03 -44.9 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.536 0.939 . . . . 1.01 113.536 -178.172 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 . . . . . 0 C--N 1.321 -0.637 0 N-CA-C 112.825 0.676 . . . . 0.91 112.825 -177.913 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.443 HG23 ' HB2' ' A' ' 77' ' ' TYR . 50.7 mm . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 121.151 0.5 . . . . 1.08 111.954 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.7 p -127.95 -175.95 3.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.626 -0.715 . . . . 1.13 109.649 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.476 ' HG3' ' CG2' ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.74 -34.29 77.83 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.372 -0.531 . . . . 1.55 109.775 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.444 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.0 -43.71 98.8 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.676 -0.773 . . . . 0.18 111.2 178.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.1 t -69.08 -40.36 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.591 0.71 . . . . 1.93 109.559 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.26 -44.16 97.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.639 -1.164 . . . . 1.05 110.826 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.46 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 25.1 mt -60.58 -47.4 86.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.722 0.296 . . . . 1.08 110.602 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -56.35 -31.47 63.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.24 110.219 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.442 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 41.8 m -77.86 -34.85 51.53 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.761 -0.654 . . . . 0.96 111.277 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.489 ' N ' HD22 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -73.43 -29.14 62.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 1.08 109.805 178.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -79.23 -45.76 19.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.698 -0.683 . . . . 1.52 110.218 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.61 -47.19 63.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.043 -0.526 . . . . 1.07 110.786 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.536 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.4 pp -68.24 -39.97 82.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.526 -0.47 . . . . 1.04 110.055 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.513 ' N ' HD13 ' A' ' 46' ' ' LEU . 41.9 t -56.85 -41.45 77.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.211 -0.45 . . . . 1.15 110.756 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.71 -39.15 90.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 1.95 110.191 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.68 -34.11 69.07 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.408 -0.59 . . . . 1.03 109.408 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.564 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -72.17 -30.33 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 109.037 -0.727 . . . . 1.02 109.037 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -81.62 -13.16 58.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.158 -0.928 . . . . 1.01 109.689 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 115.599 -0.728 . . . . 3.48 111.205 -179.766 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' A' ' 105' ' ' GLN . 5.3 p-80 . . . . . 0 N--CA 1.456 -0.156 0 N-CA-C 109.91 -0.404 . . . . 1.87 109.91 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.7 m -64.97 -10.21 27.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.9 -0.591 . . . . 2.05 110.48 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.36 -51.46 7.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.917 -0.583 . . . . 1.12 110.193 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.564 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -72.13 -34.23 49.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.58 -0.736 . . . . 1.13 109.709 178.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.542 ' HG ' ' HA ' ' A' ' 105' ' ' GLN . 2.2 tm? -64.87 -53.29 49.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.205 -0.907 . . . . 1.13 110.325 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.45 -45.36 91.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.863 -0.608 . . . . 2.32 111.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.0 74.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 1.01 111.288 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.427 ' HA2' ' CD2' ' A' ' 46' ' ' LEU . . . -75.88 -30.4 57.72 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.097 -1.049 . . . . 0.56 112.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.412 ' HZ2' ' HB3' ' A' ' 101' ' ' LEU . 1.6 tppt? -64.21 -40.3 95.78 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.36 -0.978 . . . . 1.57 108.36 177.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.2 m-80 -65.38 -39.23 91.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.626 -1.17 . . . . 0.53 109.918 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' ' 43' ' ' THR . 3.0 tm? -65.55 -49.82 67.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.312 -0.858 . . . . 2.06 110.824 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -56.52 -32.8 65.44 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.28 -1.007 . . . . 1.31 108.28 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 35.0 t -65.04 -50.28 66.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.99 -1.005 . . . . 1.45 110.773 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -63.11 -42.94 99.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.525 -0.47 . . . . 0.46 111.456 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -50.61 73.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.346 -0.388 . . . . 1.54 110.591 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.56 -36.68 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.981 -0.554 . . . . 1.13 112.384 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.2 t -88.28 -9.89 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.098 0.475 . . . . 1.51 110.502 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.443 ' HB2' HG23 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -90.14 -27.97 19.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.629 -0.714 . . . . 0.8 111.295 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HE2' ' A' ' 87' ' ' LYS . 1.2 m -69.24 -10.76 13.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.32 . . . . 1.54 111.422 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.96 -2.43 18.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.126 0.489 . . . . 1.31 110.021 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.4 t -111.61 -0.43 16.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.79 -0.641 . . . . 1.93 111.291 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.468 ' CG2' HD22 ' A' ' 86' ' ' ASN . 3.8 mm -54.99 103.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 109.839 -0.43 . . . . 1.39 109.839 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.627 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -72.17 -40.56 67.86 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.132 0.491 . . . . 2.55 109.786 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.69 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -58.99 178.54 0.11 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.487 -0.779 . . . . 3.3 109.401 179.297 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.528 ' H ' ' NE2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -136.39 -40.79 0.64 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.464 -0.494 . . . . 3.25 112.147 -178.23 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.592 ' HG2' HE22 ' A' ' 83' ' ' GLN . 18.9 ptp180 -88.88 33.09 0.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.349 0.595 . . . . 3.42 109.445 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.69 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -133.9 -33.68 1.04 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.237 -0.892 . . . . 2.49 111.035 -179.299 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.599 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 20.6 tptp -37.88 -55.22 1.22 Allowed 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.814 -0.63 . . . . 2.88 111.66 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.555 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 97.3 m-85 -56.05 -48.15 76.55 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.056 -0.52 . . . . 3.08 110.901 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.43 -66.29 0.42 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.83 0.347 . . . . 1.17 111.615 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.61 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.9 t80 -65.23 -49.1 70.97 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.995 0.739 . . . . 0.39 112.995 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.599 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 12.2 ttt180 -54.77 -64.1 0.94 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.061 0.393 . . . . 3.9 112.061 -176.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -51.6 -37.43 49.89 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.524 -0.547 . . . . 2.58 109.524 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 90' ' ' PHE . . . -56.92 -41.01 77.41 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.732 -0.667 . . . . 0.96 109.531 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -61.85 -39.12 82.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 108.951 -0.759 . . . . 1.09 108.951 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.622 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -60.4 -32.06 70.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.607 -1.179 . . . . 0.33 109.695 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.622 ' HD2' HD21 ' A' ' 95' ' ' ASN . 10.6 mptt -62.57 -49.21 76.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.688 -0.486 . . . . 2.3 109.688 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.547 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 27.7 tp -59.06 -34.24 71.72 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.634 -0.426 . . . . 1.29 110.135 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 8.0 tp10 -55.42 -57.66 10.96 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.031 -0.531 . . . . 1.87 110.185 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 45.6 m-80 -63.92 -40.02 95.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 2.12 111.123 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.534 HD21 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -51.05 -48.65 61.49 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.42 109.999 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 5.6 mt -67.25 -38.5 85.27 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.261 -0.644 . . . . 1.23 109.261 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.655 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 64.7 mtp180 -54.92 -37.59 66.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.275 -0.875 . . . . 2.63 111.473 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -90.59 -15.49 30.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.244 -0.434 . . . . 2.32 111.616 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.497 HD21 HD22 ' A' ' 64' ' ' LEU . 6.3 tp -87.3 -22.15 25.32 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.167 1.173 . . . . 1.08 114.167 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.77 HE21 ' H ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.378 0 C-N-CA 120.776 -0.37 . . . . 2.04 111.795 -178.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.403 ' CE2' HD12 ' A' ' 104' ' ' LEU . 3.1 m-30 . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.536 0.208 . . . . 0.61 111.233 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m -77.82 -14.28 59.62 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.855 -0.338 . . . . 1.78 110.449 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.475 ' HE3' ' HB2' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.8 -42.57 63.75 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.007 -0.738 . . . . 3.05 109.007 179.007 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.417 ' O ' HD11 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.25 -23.73 67.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.538 -0.912 . . . . 1.13 108.538 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.9 -48.47 30.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.858 -1.064 . . . . 1.99 110.089 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.7 t -63.05 -34.53 77.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.022 -0.535 . . . . 1.87 110.881 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 70.4 m -63.21 -48.64 77.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.968 -0.56 . . . . 1.66 111.502 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.4 HG11 ' HB ' ' A' ' 43' ' ' THR . 64.8 t -58.53 -52.89 54.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.864 0.364 . . . . 1.29 111.295 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -50.8 -42.26 57.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 3.15 111.271 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.6 tt0 -58.1 -56.11 26.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 2.1 112.265 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -50.89 -55.7 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 120.946 0.403 . . . . 1.11 111.111 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 40.0 t -54.03 -47.68 71.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.04 -0.527 . . . . 1.44 110.407 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.51 -20.28 19.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.37 111.858 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 130' ' ' GLU . 89.9 mt -89.15 -30.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.731 0.641 . . . . 1.08 112.731 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.476 ' CG2' ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -83.05 -50.94 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 114.665 1.358 . . . . 1.01 114.665 -177.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 . . . . . 0 C--N 1.326 -0.44 0 N-CA-C 113.338 0.866 . . . . 0.91 113.338 -176.841 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 121.186 0.517 . . . . 1.08 111.91 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 p -127.64 -178.25 4.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.576 -0.738 . . . . 1.13 109.296 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.527 ' HB2' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -62.52 -37.71 87.1 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.2 -0.6 . . . . 1.55 110.014 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.512 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -57.75 -46.75 91.91 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.635 -0.793 . . . . 0.18 111.147 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.6 t -65.42 -38.48 82.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.508 0.671 . . . . 1.93 109.525 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.414 ' O ' HD23 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -62.26 -42.39 95.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 114.806 -1.088 . . . . 1.05 110.374 179.347 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.45 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 19.1 mt -60.92 -48.33 82.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.203 -0.453 . . . . 1.08 110.466 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.3 -28.85 63.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.079 0.466 . . . . 0.24 110.273 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.492 ' HB2' HD23 ' A' ' 70' ' ' LEU . 58.0 m -78.87 -35.48 43.68 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.705 -0.679 . . . . 0.96 110.926 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.45 ' OG1' ' HA ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -73.69 -26.97 60.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.208 0.528 . . . . 1.08 109.909 178.464 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -80.93 -50.03 10.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.532 -0.758 . . . . 1.52 109.922 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.3 -46.71 36.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.005 -0.543 . . . . 1.07 110.838 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.586 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.2 pp -69.87 -41.81 74.32 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.879 -0.415 . . . . 1.04 109.879 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.481 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.1 t -53.82 -45.59 70.86 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.222 -0.444 . . . . 1.15 110.949 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.98 -42.86 99.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.95 110.185 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.423 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . . . -55.14 -30.29 59.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.204 -0.453 . . . . 1.03 110.166 178.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.2 mt -74.64 -39.17 46.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.289 -0.634 . . . . 1.02 109.289 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.2 t -77.18 -10.22 59.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.232 -0.895 . . . . 1.01 109.951 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' A' ' 49' ' ' ALA . 69.4 mtm180 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.591 -0.731 . . . . 3.48 110.832 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 . . . . . 0 C--O 1.23 0.069 0 N-CA-C 109.406 -0.59 . . . . 1.87 109.406 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.7 t -76.65 -11.59 59.88 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.397 -0.82 . . . . 2.05 110.752 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -48.61 13.51 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.814 -0.439 . . . . 1.12 109.814 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.495 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -69.87 -36.29 68.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.136 -0.69 . . . . 1.13 109.136 178.465 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.579 HD21 ' HB3' ' A' ' 104' ' ' LEU . 2.4 tm? -61.89 -57.8 10.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.91 -1.041 . . . . 1.13 110.72 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.34 -42.67 99.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.895 -0.593 . . . . 2.32 111.837 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.54 -32.06 72.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 1.01 110.968 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.432 ' HA2' ' CD2' ' A' ' 46' ' ' LEU . . . -78.49 -29.68 51.91 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.178 -1.011 . . . . 0.56 112.117 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.458 ' HZ1' ' HB3' ' A' ' 101' ' ' LEU . 0.7 OUTLIER -64.66 -46.31 83.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 107.997 -1.112 . . . . 1.57 107.997 177.004 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -59.85 -42.12 92.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.475 -1.239 . . . . 0.53 110.015 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.492 HD23 ' HB2' ' A' ' 42' ' ' SER . 2.4 tm? -62.57 -49.12 76.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.335 -0.848 . . . . 2.06 110.686 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.541 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . 1.4 t80 -59.02 -36.13 74.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.724 -0.671 . . . . 1.31 109.938 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 9.0 p -74.19 -24.81 59.41 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.877 -0.601 . . . . 1.45 112.559 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.418 ' O ' ' HB3' ' A' ' 77' ' ' TYR . 17.8 m-85 -78.78 -44.4 23.32 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 119.544 -0.862 . . . . 0.46 109.377 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.541 ' SG ' ' HA ' ' A' ' 71' ' ' TYR . 13.0 p -66.99 -21.72 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.37 -0.832 . . . . 1.54 109.534 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.402 HG12 ' N ' ' A' ' 76' ' ' SER . 0.6 OUTLIER -72.45 -43.93 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.588 -0.733 . . . . 1.13 110.09 179.001 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.402 ' N ' HG12 ' A' ' 75' ' ' VAL . 53.9 m -85.51 -2.5 58.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 1.51 110.253 178.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.418 ' HB3' ' O ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -99.26 -30.24 12.36 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.64 -0.709 . . . . 0.8 111.806 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.4 m -63.63 -2.86 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.121 0.415 . . . . 1.54 112.121 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -77.6 8.04 4.86 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.27 -0.423 . . . . 1.31 110.474 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.3 p -119.55 -10.45 9.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.032 -0.531 . . . . 1.93 110.884 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 78' ' ' VAL . 35.6 mm -50.31 131.37 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 116.354 -0.385 . . . . 1.39 110.897 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.661 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.3 OUTLIER -111.8 -31.19 7.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 116.407 -0.36 . . . . 2.55 111.692 -178.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.551 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 0.3 OUTLIER -43.99 -43.03 6.38 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.175 0.805 . . . . 3.3 113.175 -179.144 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.661 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 23.7 mmt 80.73 -92.89 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.701 0.63 . . . . 3.25 112.701 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -57.82 -9.88 1.46 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.003 0.43 . . . . 3.42 111.077 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.551 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -107.95 -19.3 13.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.763 -0.653 . . . . 2.49 110.18 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.585 ' HD2' ' HA ' ' A' ' 84' ' ' MET . 0.0 OUTLIER -52.32 -38.74 59.36 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.324 0.583 . . . . 2.88 109.463 179.036 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.572 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 84.2 m-85 -57.41 -42.83 83.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.796 -1.093 . . . . 3.08 109.992 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.01 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 1.17 111.224 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.592 ' O ' HG13 ' A' ' 94' ' ' ILE . 78.3 t80 -70.32 -45.59 65.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.31 -0.404 . . . . 0.39 111.917 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 9.4 ttp180 -56.73 -63.42 1.21 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.385 -0.37 . . . . 3.9 111.482 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -54.15 -34.8 61.28 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.325 -0.62 . . . . 2.58 109.325 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 90' ' ' PHE . . . -57.45 -40.15 77.83 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.884 -0.784 . . . . 0.96 108.884 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 90' ' ' PHE . 61.0 mt -60.48 -38.79 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 CA-C-N 115.139 -0.937 . . . . 1.09 109.085 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.622 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -63.4 -34.31 77.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.487 -1.233 . . . . 0.33 109.725 179.86 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.622 ' HD2' HD21 ' A' ' 95' ' ' ASN . 12.1 mptt -59.21 -45.26 91.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.657 -0.497 . . . . 2.3 109.657 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.563 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 28.7 tp -64.52 -31.77 73.12 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 116.339 -0.392 . . . . 1.29 110.305 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.1 -51.2 70.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.217 -0.447 . . . . 1.87 110.191 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 40.2 m-80 -72.65 -37.87 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.023 -0.535 . . . . 2.12 111.016 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.523 HD21 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -50.27 -45.54 54.44 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.499 -0.556 . . . . 0.42 109.499 178.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 7.5 mt -66.82 -38.86 87.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.364 -0.835 . . . . 1.23 109.14 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.574 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 48.6 mtt-85 -57.6 -35.12 70.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.427 -0.806 . . . . 2.63 111.214 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -88.02 -18.47 28.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.169 0.509 . . . . 2.32 109.845 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.579 ' HB3' HD21 ' A' ' 64' ' ' LEU . 14.9 tp -81.1 -34.67 32.46 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 114.092 1.145 . . . . 1.08 114.092 -178.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.574 ' NE2' ' O ' ' A' ' 102' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.495 0 C-N-CA 120.103 -0.639 . . . . 2.04 110.457 -177.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.463 ' CD2' HD12 ' A' ' 104' ' ' LEU . 2.7 m-30 . . . . . 0 N--CA 1.453 -0.323 0 N-CA-C 111.644 0.239 . . . . 0.61 111.644 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 93.6 p -83.08 -25.57 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.709 -0.478 . . . . 1.78 109.709 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -67.17 -31.07 71.23 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.32 -0.993 . . . . 3.05 108.32 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.469 ' O ' HD11 ' A' ' 124' ' ' LEU . 2.2 tp -70.11 -22.95 62.97 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.155 -0.929 . . . . 1.13 108.55 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.82 -49.67 19.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.066 -0.97 . . . . 1.99 110.069 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 m -67.12 -30.1 70.02 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.93 -0.577 . . . . 1.87 110.486 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.5 m -65.56 -44.76 85.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.831 -0.622 . . . . 1.66 111.11 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.43 HG12 ' HB ' ' A' ' 43' ' ' THR . 41.7 t -61.64 -53.8 43.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 1.29 111.32 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -51.87 -39.14 58.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.208 -0.451 . . . . 3.15 111.118 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.03 -50.8 71.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 2.1 112.311 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -55.48 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.78 0.324 . . . . 1.11 111.053 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.1 t -53.48 -45.56 69.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 1.44 111.131 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.71 -34.0 50.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.004 0.372 . . . . 0.37 112.004 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.6 mt -74.42 -51.23 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.661 0.615 . . . . 1.08 112.661 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.527 HG22 ' HB2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -56.79 -35.51 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 112.517 0.562 . . . . 1.01 112.517 -178.752 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 . . . . . 0 C--N 1.318 -0.766 0 C-N-CA 120.701 -0.4 . . . . 0.91 110.307 -179.973 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.5 mm . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 121.091 0.472 . . . . 1.08 110.726 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.5 p -129.22 -175.27 3.51 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.734 . . . . 1.13 109.347 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HB2' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -63.41 -30.99 72.02 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.203 -0.666 . . . . 1.55 109.203 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.438 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.52 -47.81 79.98 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.134 -0.787 . . . . 0.18 111.134 178.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 52.2 t -63.91 -40.3 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 CA-C-O 121.682 0.753 . . . . 1.93 109.25 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.4 HG12 ' SG ' ' A' ' 74' ' ' CYS . 0.9 OUTLIER -63.04 -39.84 86.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.339 -1.3 . . . . 1.05 110.8 179.543 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.41 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 20.5 mt -65.81 -49.24 68.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.434 -0.348 . . . . 1.08 110.422 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -54.38 -33.51 59.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.59 -0.522 . . . . 0.24 109.59 178.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m -70.97 -41.72 70.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.561 -0.745 . . . . 0.96 110.789 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.583 HG22 HD12 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -63.75 -33.2 75.13 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.948 0.404 . . . . 1.08 110.703 179.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -72.74 -55.05 7.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 1.52 111.367 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.11 -47.51 23.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 1.07 111.296 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.65 HD23 HD23 ' A' ' 70' ' ' LEU . 4.1 pp -71.08 -38.88 72.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 1.04 110.08 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 34.6 t -53.89 -52.27 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 1.15 110.416 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mp -60.2 -35.03 74.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.033 -0.53 . . . . 1.95 110.003 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.414 ' HB2' ' HB3' ' A' ' 62' ' ' ALA . . . -60.23 -35.58 75.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 1.03 109.75 178.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.539 HG12 ' HB ' ' A' ' 63' ' ' VAL . 3.0 mt -69.56 -40.2 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 N-CA-C 109.027 -0.731 . . . . 1.02 109.027 178.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.9 t -75.02 -9.38 58.48 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.022 -0.99 . . . . 1.01 109.98 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 115.543 -0.753 . . . . 3.48 110.793 -179.985 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 t-80 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.761 0.315 . . . . 1.87 110.866 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.2 p -97.12 -33.79 11.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.978 0.418 . . . . 2.05 110.713 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.414 ' HB3' ' HB2' ' A' ' 49' ' ' ALA . . . -81.49 -55.06 4.93 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.491 0.923 . . . . 1.12 113.491 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.539 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -64.85 -32.23 57.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 120.716 -0.394 . . . . 1.13 110.834 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.76 -58.4 3.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.453 -0.339 . . . . 1.13 111.192 178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -58.59 -44.67 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.385 0.612 . . . . 2.32 110.343 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.89 -26.51 63.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.343 -0.984 . . . . 1.01 108.343 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.89 -46.64 91.08 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 114.835 -1.075 . . . . 0.56 112.488 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' HD2' HD11 ' A' ' 101' ' ' LEU . 1.3 mptm? -64.99 -42.91 94.1 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.881 0.372 . . . . 1.57 110.826 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -58.09 -39.04 77.59 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.924 -0.58 . . . . 0.53 110.777 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.65 HD23 HD23 ' A' ' 46' ' ' LEU . 10.6 tp -66.63 -50.58 62.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 2.06 111.337 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 98' ' ' GLU . 15.1 t80 -54.76 -35.75 64.11 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.083 -0.71 . . . . 1.31 109.083 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 t -67.14 -41.96 85.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.999 -1.0 . . . . 1.45 111.848 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.4 -43.31 81.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 119.918 -0.713 . . . . 0.46 110.47 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.409 ' O ' HG21 ' A' ' 78' ' ' VAL . 1.1 m -62.79 -22.89 66.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.866 -0.606 . . . . 1.54 109.972 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 1.2 t -75.17 -45.72 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.576 -0.738 . . . . 1.13 111.03 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.1 m -83.87 -3.32 57.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 1.51 110.665 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -96.38 -32.21 12.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.811 -0.631 . . . . 0.8 111.326 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.4 m -67.86 -6.06 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.048 0.451 . . . . 1.54 111.674 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -79.6 8.46 6.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.119 -0.491 . . . . 1.31 110.084 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 t -127.64 -5.16 5.84 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.853 -0.612 . . . . 1.93 111.054 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.649 HG13 ' HG3' ' A' ' 87' ' ' LYS . 28.9 mm -31.75 -66.02 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.079 0 N-CA-C 112.417 0.525 . . . . 1.39 112.417 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.592 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 77.49 -43.88 0.42 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.263 0.838 . . . . 2.55 113.263 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.711 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 1.5 mt-30 -50.33 -26.39 4.8 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.039 0.755 . . . . 3.3 113.039 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.53 ' C ' ' H ' ' A' ' 86' ' ' ASN . 27.6 mtm 74.47 -86.87 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.973 1.101 . . . . 3.25 113.973 177.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -64.75 6.36 0.23 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.963 0.411 . . . . 3.42 111.722 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.711 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -119.39 -12.51 9.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.528 0.68 . . . . 2.49 109.407 -179.794 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.649 ' HG3' HG13 ' A' ' 81' ' ' ILE . 2.2 ttpp -57.8 -47.45 82.54 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.752 -1.113 . . . . 2.88 110.751 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -55.82 -46.17 78.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.484 -0.78 . . . . 3.08 110.75 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 92' ' ' GLU . . . -47.55 -70.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.412 0.523 . . . . 1.17 112.412 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.571 ' O ' HG13 ' A' ' 94' ' ' ILE . 63.7 t80 -62.47 -43.62 98.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.364 0.505 . . . . 0.39 112.364 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 8.2 ttp180 -56.02 -62.14 1.91 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.617 -0.265 . . . . 3.9 111.423 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -52.96 -33.1 49.51 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.522 -0.308 . . . . 2.58 110.549 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.94 85.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.478 0.656 . . . . 0.96 109.703 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 90' ' ' PHE . 6.3 mt -64.25 -34.31 68.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.351 -0.84 . . . . 1.09 109.471 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.598 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -63.41 -36.09 82.59 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.882 -1.054 . . . . 0.33 109.308 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.598 ' HD2' HD21 ' A' ' 95' ' ' ASN . 0.8 OUTLIER -59.65 -47.63 84.87 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.213 -0.662 . . . . 2.3 109.213 178.555 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.626 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.74 -39.75 85.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.512 -0.767 . . . . 1.29 109.832 178.452 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.453 ' HB2' ' CD1' ' A' ' 71' ' ' TYR . 8.6 tp10 -57.38 -58.01 10.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.466 -0.788 . . . . 1.87 111.029 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.522 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 52.9 m-80 -61.79 -31.68 71.91 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.717 -0.475 . . . . 2.12 109.717 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.589 HD21 HD22 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -63.14 -38.47 91.32 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.699 -0.852 . . . . 0.42 108.699 178.261 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 8.9 mt -67.39 -41.7 84.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.159 -1.052 . . . . 1.23 108.159 177.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.619 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 71.3 mtp180 -56.27 -38.59 71.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.242 -1.344 . . . . 2.63 111.549 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -89.45 -17.77 28.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.035 -0.529 . . . . 2.32 111.743 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.431 HD13 ' CD2' ' A' ' 121' ' ' PHE . 16.5 tp -86.13 -25.31 25.83 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.935 1.087 . . . . 1.08 113.935 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.732 HE21 ' H ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 120.554 -0.458 . . . . 2.04 110.451 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.462 ' HB2' HG21 ' A' ' 50' ' ' ILE . 1.4 m-30 . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.48 0.181 . . . . 0.61 111.448 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.4 m -67.06 -21.54 65.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 1.78 110.363 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.427 ' N ' ' HD3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -65.67 -42.14 91.67 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.348 -0.612 . . . . 3.05 109.348 178.864 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.512 HD21 HD22 ' A' ' 100' ' ' ASN . 2.4 tp -60.79 -26.51 67.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.858 -0.793 . . . . 1.13 108.858 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 tp -70.25 -49.07 53.71 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.232 -0.895 . . . . 1.99 109.933 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -63.19 -36.15 82.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.886 -0.597 . . . . 1.87 110.482 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 131' ' ' ILE . 74.0 m -59.72 -42.56 93.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.833 -0.622 . . . . 1.66 110.729 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.448 HG13 HG21 ' A' ' 43' ' ' THR . 41.8 t -60.32 -53.11 53.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.053 -0.521 . . . . 1.29 111.019 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -50.67 -43.32 57.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 3.15 111.33 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.81 -56.35 22.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 2.1 112.209 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 127' ' ' SER . 0.1 OUTLIER -50.34 -55.7 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 121.018 -0.273 . . . . 1.11 111.179 -178.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 56.7 p -55.25 -46.26 76.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.94 0.4 . . . . 1.44 110.405 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -53.51 -21.82 7.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.089 -0.505 . . . . 0.37 111.89 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 70.1 mt -88.34 -48.39 14.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.643 0.609 . . . . 1.08 112.643 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.503 HG22 ' HB2' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -59.91 -50.34 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 114.371 1.248 . . . . 1.01 114.371 -177.693 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 . . . . . 0 C--N 1.325 -0.489 0 N-CA-C 112.134 0.42 . . . . 0.91 112.134 -177.456 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.643 ' HA ' HG13 ' A' ' 38' ' ' VAL . 40.5 mm . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.21 0.528 . . . . 1.08 112.023 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.469 ' O ' HG11 ' A' ' 38' ' ' VAL . 81.9 p -126.57 -159.57 0.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.441 -0.799 . . . . 1.13 109.614 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.498 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -74.45 -27.76 60.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.718 -0.475 . . . . 1.55 109.718 178.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.55 -47.96 82.26 Favored Glycine 0 N--CA 1.453 -0.188 0 CA-C-N 115.642 -0.708 . . . . 0.18 112.021 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.643 HG13 ' HA ' ' A' ' 34' ' ' ILE . 12.4 p -66.68 -37.69 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.518 0.675 . . . . 1.93 109.366 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.454 ' N ' HG12 ' A' ' 38' ' ' VAL . 1.1 t -63.51 -41.48 92.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.622 -1.172 . . . . 1.05 110.962 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.419 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 31.4 mt -65.23 -51.29 61.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.789 0.328 . . . . 1.08 110.285 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.28 -31.41 32.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.152 0.501 . . . . 0.24 109.765 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.3 m -73.14 -42.41 62.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.415 -0.811 . . . . 0.96 111.093 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.544 HG23 HD12 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -63.01 -35.47 80.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.338 . . . . 1.08 111.184 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -72.95 -53.8 10.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 1.52 111.508 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.58 -47.86 28.35 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.348 -0.387 . . . . 1.07 111.69 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.581 HD22 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -70.67 -39.63 73.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.483 -0.326 . . . . 1.04 110.172 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 47.2 t -55.25 -37.98 67.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 1.15 109.93 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.67 -36.25 78.28 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.661 -0.7 . . . . 1.95 109.717 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.74 77.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.605 -0.517 . . . . 1.03 109.605 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.507 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -71.96 -27.37 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 N-CA-C 108.779 -0.823 . . . . 1.02 108.779 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -83.72 -14.82 50.73 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.18 -0.918 . . . . 1.01 109.696 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 115.588 -0.733 . . . . 3.48 111.323 -179.865 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 121.005 0.431 . . . . 1.87 109.989 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -78.34 -9.02 59.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.662 -0.699 . . . . 2.05 110.539 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.67 -45.81 23.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 1.12 110.403 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.507 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -76.19 -27.9 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.718 -0.673 . . . . 1.13 109.974 179.006 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.602 HD21 ' NE2' ' A' ' 105' ' ' GLN . 2.1 tm? -73.9 -52.45 12.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.35 -0.841 . . . . 1.13 110.793 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -60.23 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.484 0.659 . . . . 2.32 109.463 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.99 -27.9 67.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.064 -0.971 . . . . 1.01 108.419 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.78 -47.31 87.48 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.874 -1.057 . . . . 0.56 112.154 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -38.14 86.14 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.057 0.456 . . . . 1.57 110.098 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.454 ' N ' HD21 ' A' ' 69' ' ' ASN . 0.9 OUTLIER -60.22 -46.03 91.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.658 -0.701 . . . . 0.53 110.5 179.685 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.581 HD22 HD22 ' A' ' 46' ' ' LEU . 14.4 tp -57.99 -48.41 80.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.766 -0.652 . . . . 2.06 110.689 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.473 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 23.8 t80 -59.22 -34.98 72.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.201 -0.454 . . . . 1.31 110.059 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 t -76.46 -19.33 58.14 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.85 -0.614 . . . . 1.45 112.009 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -84.71 -44.64 13.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.789 -0.819 . . . . 0.46 108.789 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.465 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 4.3 m -69.44 -20.33 63.77 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.643 -0.708 . . . . 1.54 109.09 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.473 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.8 OUTLIER -72.96 -45.37 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-N 115.617 -0.719 . . . . 1.13 110.364 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.7 t -81.17 -11.06 59.52 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 121.064 0.459 . . . . 1.51 110.357 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.434 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -93.57 -29.19 15.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.668 -0.696 . . . . 0.8 110.407 179.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.516 ' O ' HG12 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -62.1 -30.05 47.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.846 -0.615 . . . . 1.54 111.858 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.87 -4.45 20.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.067 0.461 . . . . 1.31 110.297 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -104.87 7.07 34.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.688 -0.687 . . . . 1.93 111.444 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.586 ' HB ' ' HD2' ' A' ' 87' ' ' LYS . 5.5 mm -70.11 95.92 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.868 0.366 . . . . 1.39 110.952 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.609 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.0 OUTLIER -80.91 -26.04 37.08 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.76 -0.83 . . . . 2.55 108.76 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.818 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 5.7 mm100 -37.63 -41.65 0.49 Allowed 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.201 -1.363 . . . . 3.3 113.9 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.609 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 19.1 mmt 82.09 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.856 1.058 . . . . 3.25 113.856 178.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -71.74 29.92 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.976 0.417 . . . . 3.42 111.3 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.818 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -138.8 -23.94 0.93 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.891 -0.595 . . . . 2.49 110.795 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.588 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 5.4 mtmt -39.13 -54.52 1.74 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.859 -0.61 . . . . 2.88 111.045 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.413 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 88.5 m-85 -55.34 -48.94 73.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.534 -0.757 . . . . 3.08 111.453 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.41 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -47.03 -69.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.909 0.337 . . . . 1.17 111.909 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.574 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 t80 -60.05 -44.55 94.61 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.184 0.438 . . . . 0.39 112.184 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.588 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -55.1 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.585 0.231 . . . . 3.9 111.387 -178.337 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 12.1 pt-20 -50.82 -36.74 38.88 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.333 -0.394 . . . . 2.58 110.235 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.11 -39.63 82.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.125 0.488 . . . . 0.96 109.822 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.574 HG13 ' O ' ' A' ' 90' ' ' PHE . 9.1 mt -62.97 -38.97 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 CA-C-N 115.62 -0.718 . . . . 1.09 109.396 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.527 ' ND2' ' N ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -57.57 -43.62 84.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.834 -1.075 . . . . 0.33 110.045 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.527 ' N ' ' ND2' ' A' ' 95' ' ' ASN . 0.1 OUTLIER -56.42 -50.36 71.86 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.336 -0.393 . . . . 2.3 110.264 179.159 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.616 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -54.93 -41.62 71.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.816 -0.629 . . . . 1.29 109.804 178.76 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.466 ' HB3' ' O ' ' A' ' 95' ' ' ASN . 7.8 tp10 -57.1 -59.97 4.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.443 -0.799 . . . . 1.87 110.881 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -66.72 -9.33 35.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 2.12 110.227 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.642 HD21 HD23 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -85.13 -37.73 19.89 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.516 -1.29 . . . . 0.42 107.516 178.773 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.642 HD23 HD21 ' A' ' 100' ' ' ASN . 7.6 mt -67.75 -39.88 84.16 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.416 -1.327 . . . . 1.23 107.416 177.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.583 ' O ' ' HB2' ' A' ' 105' ' ' GLN . 75.1 mtt180 -55.9 -53.52 55.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.293 -1.321 . . . . 2.63 110.686 178.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -68.93 -23.89 64.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.709 -0.478 . . . . 2.32 109.709 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 38.6 tp -76.13 -17.54 59.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.621 -0.718 . . . . 1.08 110.339 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.602 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 115.68 -0.691 . . . . 2.04 110.398 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.483 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 112.176 0.436 . . . . 0.61 112.176 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 88.6 p -75.68 -16.7 60.14 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.737 -0.468 . . . . 1.78 109.737 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.442 ' HE2' ' HB2' ' A' ' 123' ' ' LYS . 3.4 mppt? -69.9 -41.91 74.08 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.049 -0.722 . . . . 3.05 109.049 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.601 HD22 HD22 ' A' ' 100' ' ' ASN . 1.3 tp -61.63 -25.31 67.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.575 -0.898 . . . . 1.13 108.575 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.29 -48.7 49.1 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.007 -0.997 . . . . 1.99 109.925 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 50.7 m -63.43 -35.75 81.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.754 -0.657 . . . . 1.87 110.51 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 131' ' ' ILE . 39.9 t -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 1.66 110.74 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.441 HG11 HG22 ' A' ' 43' ' ' THR . 17.9 t -60.87 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 1.29 111.124 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -54.57 -38.28 66.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.577 -0.738 . . . . 3.15 112.073 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -60.86 -56.17 24.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.474 0.546 . . . . 2.1 112.474 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.497 ' H ' HG13 ' A' ' 131' ' ' ILE . 1.3 mt -52.68 -54.15 17.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 121.078 0.466 . . . . 1.11 110.811 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.5 t -53.45 -47.91 69.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.762 -0.653 . . . . 1.44 111.18 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.16 -25.81 61.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.37 111.626 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 78.1 mt -73.33 -51.88 23.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.039 0.385 . . . . 1.08 112.039 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.498 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -62.19 -35.94 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.309 0.485 . . . . 1.01 112.309 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 120.981 -0.288 . . . . 0.91 111.231 -179.728 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.626 ' HA ' HG11 ' A' ' 38' ' ' VAL . 37.1 mm . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.25 0.548 . . . . 1.08 111.091 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.496 ' O ' HG12 ' A' ' 38' ' ' VAL . 73.9 p -125.65 -158.98 0.87 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.766 -0.828 . . . . 1.13 108.766 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.523 ' HB2' HG22 ' A' ' 135' ' ' VAL . 6.1 ttpt -66.5 -35.93 81.48 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.91 -0.716 . . . . 1.55 109.141 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.21 -49.37 63.78 Favored Glycine 0 N--CA 1.452 -0.237 0 CA-C-N 114.989 -1.005 . . . . 0.18 113.005 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.626 HG11 ' HA ' ' A' ' 34' ' ' ILE . 9.7 p -65.26 -37.81 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.205 0 CA-C-O 121.467 0.651 . . . . 1.93 109.866 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.559 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.0 OUTLIER -65.03 -36.31 77.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 114.671 -1.15 . . . . 1.05 111.08 -179.753 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.462 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 26.8 mt -71.13 -51.54 24.41 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.916 -0.314 . . . . 1.08 110.548 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -54.04 -34.18 59.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.24 109.801 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.472 ' C ' HD21 ' A' ' 70' ' ' LEU . 65.9 m -73.62 -44.16 57.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.401 -0.818 . . . . 0.96 111.179 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.601 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.8 OUTLIER -64.25 -31.44 72.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.986 0.422 . . . . 1.08 110.566 178.622 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -72.46 -54.94 7.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.826 -0.625 . . . . 1.52 111.06 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.79 -47.33 20.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.115 -0.493 . . . . 1.07 111.382 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.1 pp -72.11 -38.83 69.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.827 -0.349 . . . . 1.04 110.355 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.41 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.4 t -55.35 -37.65 67.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 1.15 110.249 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.96 -38.82 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.923 -0.58 . . . . 1.95 110.0 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.38 -46.3 76.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.717 -0.475 . . . . 1.03 109.717 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.584 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -62.3 -39.74 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.817 -0.809 . . . . 1.02 108.817 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.0 t -61.43 -17.04 52.47 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.585 -0.895 . . . . 1.01 108.585 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.3 mtt180 . . . . . 0 N--CA 1.452 -0.334 0 CA-C-N 114.854 -1.066 . . . . 3.48 110.923 179.581 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 . . . . . 0 CA--C 1.522 -0.118 0 N-CA-C 109.466 -0.568 . . . . 1.87 109.466 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.8 m -70.88 -8.25 51.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.473 -0.785 . . . . 2.05 110.335 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -47.17 15.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.155 0.502 . . . . 1.12 109.996 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.584 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.98 -28.79 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.449 -0.796 . . . . 1.13 109.775 178.832 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.617 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.0 OUTLIER -73.86 -51.49 16.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.132 -0.94 . . . . 1.13 111.015 179.002 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.48 -50.72 70.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.242 0.544 . . . . 2.32 109.723 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.74 -26.91 67.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.375 -0.972 . . . . 1.01 108.375 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.427 ' HA2' HD23 ' A' ' 46' ' ' LEU . . . -64.14 -46.48 90.97 Favored Glycine 0 N--CA 1.442 -0.906 0 CA-C-N 114.865 -1.061 . . . . 0.56 112.324 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.451 ' HZ3' HE22 ' A' ' 105' ' ' GLN . 0.4 OUTLIER -63.18 -41.83 99.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.74 0.305 . . . . 1.57 110.687 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.462 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.7 m-80 -58.42 -40.46 82.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.53 110.995 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.601 HD21 ' N ' ' A' ' 43' ' ' THR . 2.6 tm? -65.35 -50.47 65.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 2.06 110.865 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.431 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 12.6 t80 -56.44 -29.86 62.15 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.375 -0.972 . . . . 1.31 108.375 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 32.8 t -67.73 -53.35 28.16 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.927 -1.033 . . . . 1.45 111.112 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.03 -43.62 95.18 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.306 -0.558 . . . . 0.46 111.715 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.475 ' HG ' HG22 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -59.63 -52.09 67.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.927 0.394 . . . . 1.54 110.904 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.45 -33.92 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 112.871 0.693 . . . . 1.13 112.871 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.5 t -90.92 -13.36 33.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.038 0.447 . . . . 1.51 110.794 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.455 ' HB2' HG21 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -88.24 -24.2 23.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.684 -0.689 . . . . 0.8 111.379 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.7 m -69.8 -12.89 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 1.54 111.374 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -68.59 -5.64 21.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 1.31 110.355 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.8 m -118.36 6.89 11.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.854 -0.612 . . . . 1.93 111.449 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.492 ' CG2' HD22 ' A' ' 86' ' ' ASN . 1.0 OUTLIER -47.68 -24.95 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.211 0.448 . . . . 1.39 112.211 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.552 ' C ' ' NE2' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 64.32 -70.38 0.08 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.144 0.497 . . . . 2.55 110.276 -177.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.625 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 2.3 mm100 -51.8 173.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.122 -0.945 . . . . 3.3 109.801 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.615 ' H ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -140.42 -20.22 0.85 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.46 -0.496 . . . . 3.25 111.418 -178.196 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -95.34 15.86 18.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.857 -0.794 . . . . 3.42 108.857 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.66 ' H ' HD21 ' A' ' 86' ' ' ASN . 0.1 OUTLIER -128.87 -30.88 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.863 -1.062 . . . . 2.49 110.863 -179.029 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 11.1 tttm -42.37 -52.23 4.64 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.878 -0.601 . . . . 2.88 111.916 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -55.04 -45.89 75.28 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.846 -0.341 . . . . 3.08 110.827 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -50.58 -71.0 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.914 0.387 . . . . 1.17 111.987 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 71.4 t80 -61.37 -46.02 91.92 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.476 0.547 . . . . 0.39 112.476 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.616 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -56.48 -57.96 10.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.536 0.207 . . . . 3.9 111.235 -178.084 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.7 pt-20 -50.3 -37.64 37.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.4 -0.364 . . . . 2.58 110.165 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.0 -41.66 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.38 0.61 . . . . 0.96 109.569 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' PHE . 17.8 mt -62.48 -42.97 97.78 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.433 -0.803 . . . . 1.09 109.328 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.574 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -55.7 -38.9 70.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.86 -1.064 . . . . 0.33 109.371 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.574 ' HD2' HD21 ' A' ' 95' ' ' ASN . 1.1 mptm? -57.17 -46.98 82.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.978 -0.556 . . . . 2.3 109.956 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.582 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 33.2 tp -58.96 -36.15 74.34 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 120.956 0.408 . . . . 1.29 110.147 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.7 OUTLIER -57.24 -59.08 5.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.871 -0.604 . . . . 1.87 110.169 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.414 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 34.1 m-80 -71.31 -10.06 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.853 -0.612 . . . . 2.12 111.032 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.478 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.47 -47.95 14.75 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 108.58 -0.896 . . . . 0.42 108.58 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 7.5 mt -64.44 -33.86 76.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.393 -0.966 . . . . 1.23 108.393 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 81.4 mtt180 -55.04 -55.68 28.3 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 114.944 -1.025 . . . . 2.63 110.899 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -73.1 -19.69 61.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.022 0.439 . . . . 2.32 110.47 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.528 HD22 HD23 ' A' ' 64' ' ' LEU . 51.6 tp -76.27 -16.94 59.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.769 -0.65 . . . . 1.08 111.286 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.617 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 116.374 -0.376 . . . . 2.04 111.232 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.453 ' HB2' HG23 ' A' ' 50' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.027 0.381 . . . . 0.61 112.027 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 80.2 p -69.75 -17.05 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.676 -0.41 . . . . 1.78 110.014 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -48.21 68.13 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.651 -0.87 . . . . 3.05 108.651 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.484 HD12 ' O ' ' A' ' 124' ' ' LEU . 1.5 tp -54.24 -25.76 24.98 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.214 -0.903 . . . . 1.13 109.251 177.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.78 -48.41 54.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.328 -0.851 . . . . 1.99 110.247 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.5 p -66.85 -35.04 79.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.126 -0.488 . . . . 1.87 111.116 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 26.0 t -62.77 -42.53 99.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 1.66 111.302 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.14 -50.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.113 -0.494 . . . . 1.29 110.852 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -53.19 -37.65 62.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.89 -0.595 . . . . 3.15 110.548 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.406 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.5 tt0 -60.46 -56.43 21.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.712 -0.677 . . . . 2.1 112.32 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.62 -55.74 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.95 0.405 . . . . 1.11 111.187 -178.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.414 ' OG ' ' NE2' ' A' ' 136' ' ' GLN . 7.5 t -54.13 -45.57 71.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.61 . . . . 1.44 111.353 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.45 -26.06 64.9 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.151 0.426 . . . . 0.37 112.151 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 130' ' ' GLU . 81.3 mt -75.5 -52.51 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 112.041 0.386 . . . . 1.08 112.041 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.523 HG22 ' HB2' ' A' ' 36' ' ' LYS . 1.4 p -59.67 -37.45 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 112.537 0.569 . . . . 1.01 112.537 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . 0.414 ' NE2' ' OG ' ' A' ' 132' ' ' SER . 66.9 mt-30 . . . . . 0 C--N 1.322 -0.598 0 C-N-CA 120.75 -0.38 . . . . 0.91 110.711 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.636 ' HA ' HG13 ' A' ' 38' ' ' VAL . 44.2 mm . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.265 0.555 . . . . 1.08 112.215 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.49 ' O ' HG11 ' A' ' 38' ' ' VAL . 81.9 p -123.08 -160.46 0.9 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.266 -0.879 . . . . 1.13 109.09 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.482 ' HG3' HG23 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.28 -30.52 60.46 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.177 -0.609 . . . . 1.55 109.408 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.83 -47.61 89.61 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.418 -0.81 . . . . 0.18 111.827 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.636 HG13 ' HA ' ' A' ' 34' ' ' ILE . 13.9 p -67.09 -37.97 80.32 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-O 121.455 0.645 . . . . 1.93 109.34 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.451 ' N ' HG12 ' A' ' 38' ' ' VAL . 1.7 t -60.52 -42.79 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 114.747 -1.115 . . . . 1.05 111.17 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.448 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.0 mt -67.11 -51.51 53.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.243 -0.28 . . . . 1.08 110.243 178.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -52.78 -30.94 35.84 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.178 -0.675 . . . . 0.24 109.178 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.482 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 66.2 m -73.16 -52.67 13.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.177 -0.92 . . . . 0.96 110.664 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.572 HG23 HD21 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -55.62 -29.37 59.05 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.88 0.371 . . . . 1.08 110.87 178.429 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -75.07 -51.86 12.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.102 -0.499 . . . . 1.52 110.661 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.23 -46.78 35.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.97 -0.559 . . . . 1.07 110.992 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.485 ' O ' HG13 ' A' ' 50' ' ' ILE . 3.9 pp -72.71 -40.66 65.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.325 -0.398 . . . . 1.04 110.173 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.42 ' N ' HD13 ' A' ' 46' ' ' LEU . 44.0 t -54.15 -36.21 63.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.089 0.471 . . . . 1.15 110.001 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.78 -34.49 64.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 1.95 109.793 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.02 -36.13 76.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.487 -0.56 . . . . 1.03 109.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.517 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -72.81 -32.3 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 N-CA-C 108.496 -0.927 . . . . 1.02 108.496 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -76.97 -15.29 59.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.118 -0.946 . . . . 1.01 109.389 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 115.512 -0.767 . . . . 3.48 110.934 -179.964 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.094 0.473 . . . . 1.87 109.744 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 48.2 t -78.8 -10.94 59.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.66 -0.7 . . . . 2.05 110.325 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.25 -46.18 23.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.582 . . . . 1.12 110.341 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.517 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -71.29 -25.71 25.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 1.13 109.235 178.534 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.612 HD23 ' NE2' ' A' ' 105' ' ' GLN . 1.7 tm? -75.63 -48.5 21.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.879 -1.055 . . . . 1.13 110.425 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -61.35 -52.23 65.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.609 0.718 . . . . 2.32 109.272 179.017 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.04 -26.84 67.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.588 -1.187 . . . . 1.01 108.448 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.86 -49.21 69.59 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.06 -0.973 . . . . 0.56 112.478 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.503 ' NZ ' HE22 ' A' ' 105' ' ' GLN . 1.0 OUTLIER -60.72 -43.72 97.52 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.864 0.364 . . . . 1.57 110.399 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.406 ' HB3' ' CZ ' ' A' ' 73' ' ' PHE . 17.6 m-80 -58.39 -42.19 86.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.878 -0.601 . . . . 0.53 110.777 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.572 HD21 HG23 ' A' ' 43' ' ' THR . 1.1 tm? -58.5 -48.66 80.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 2.06 110.223 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.467 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 47.8 t80 -60.62 -33.29 72.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 1.31 110.914 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.4 p -80.76 -16.77 52.96 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.207 0.447 . . . . 1.45 112.207 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.406 ' CZ ' ' HB3' ' A' ' 69' ' ' ASN . 24.3 m-85 -80.28 -44.29 19.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.506 -0.924 . . . . 0.46 108.506 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.439 ' O ' HG11 ' A' ' 78' ' ' VAL . 7.8 m -70.93 -27.4 63.74 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.337 -0.847 . . . . 1.54 109.15 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.467 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -64.57 -38.32 82.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-N 115.618 -0.719 . . . . 1.13 110.95 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.8 t -91.27 -11.71 37.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.922 0.392 . . . . 1.51 110.44 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.432 ' HB2' HG21 ' A' ' 34' ' ' ILE . 1.2 t80 -90.7 -26.58 19.48 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.919 -0.582 . . . . 0.8 111.929 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.492 HG12 ' HG2' ' A' ' 91' ' ' ARG . 2.8 m -63.06 -10.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 121.125 0.488 . . . . 1.54 111.044 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.0 6.67 3.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.958 -0.565 . . . . 1.31 110.598 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 41.1 t -126.66 -1.17 6.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.039 -0.528 . . . . 1.93 111.106 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.472 ' O ' ' N ' ' A' ' 83' ' ' GLN . 18.3 mm -40.74 -30.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 112.444 0.535 . . . . 1.39 112.444 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.537 ' C ' ' NE2' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 61.57 -72.36 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 123.767 0.667 . . . . 2.55 109.863 -178.175 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.672 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -49.02 156.5 0.51 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.256 -1.016 . . . . 3.3 108.256 179.371 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.431 ' C ' ' H ' ' A' ' 86' ' ' ASN . 1.4 ptm -122.48 -34.66 3.22 Favored 'General case' 0 C--N 1.314 -0.957 0 C-N-CA 120.019 -0.672 . . . . 3.25 112.723 -177.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.644 ' HG2' HE22 ' A' ' 83' ' ' GLN . 39.6 ptt180 -86.02 27.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.315 -0.624 . . . . 3.42 109.315 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.672 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -132.11 -29.47 1.63 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.9 -1.046 . . . . 2.49 110.77 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.55 ' N ' ' ND2' ' A' ' 86' ' ' ASN . 7.8 mttt -39.69 -50.19 2.3 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.731 -0.668 . . . . 2.88 111.519 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -56.39 -48.74 76.27 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.238 -0.437 . . . . 3.08 110.455 -179.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.09 -68.37 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.046 0.388 . . . . 1.17 112.046 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.529 ' O ' HG13 ' A' ' 94' ' ' ILE . 89.5 t80 -66.43 -50.23 64.09 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.429 0.899 . . . . 0.39 113.429 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.529 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -58.55 -47.86 82.81 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.339 -0.144 . . . . 3.9 111.308 -176.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -58.9 -37.88 77.61 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.651 -0.5 . . . . 2.58 109.651 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.18 -41.28 88.11 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.172 -0.677 . . . . 0.96 109.172 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 90' ' ' PHE . 40.4 mt -60.19 -42.75 91.39 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.289 -0.869 . . . . 1.09 109.039 178.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.602 ' ND2' ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.53 -44.79 89.69 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 114.556 -1.202 . . . . 0.33 109.666 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.602 ' HD2' ' ND2' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -48.44 -45.82 36.92 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.093 0.473 . . . . 2.3 109.783 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.675 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -60.63 -40.75 93.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.76 . . . . 1.29 110.055 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -55.29 -61.29 2.43 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.707 -0.679 . . . . 1.87 111.627 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.442 ' ND2' ' O ' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -60.42 -35.44 75.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.907 -0.405 . . . . 2.12 109.907 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.577 HD21 HD22 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -58.93 -34.58 71.9 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.895 -0.779 . . . . 0.42 108.895 177.434 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 10.9 mt -71.06 -41.65 70.45 Favored 'General case' 0 C--N 1.34 0.171 0 N-CA-C 108.307 -0.997 . . . . 1.23 108.307 177.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 90.8 mtt180 -54.21 -47.85 71.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.693 -1.14 . . . . 2.63 111.478 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -79.01 -23.99 43.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.862 0.363 . . . . 2.32 110.66 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.415 HD23 HG23 ' A' ' 63' ' ' VAL . 36.3 tp -73.66 -15.8 61.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 1.08 111.334 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.612 ' NE2' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.175 0 CA-C-N 116.386 -0.37 . . . . 2.04 110.912 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.427 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 1.6 m-30 . . . . . 0 C--O 1.231 0.126 0 N-CA-C 112.021 0.378 . . . . 0.61 112.021 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 89.7 p -67.93 -15.93 63.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 1.78 110.085 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -36.65 75.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.13 -0.693 . . . . 3.05 109.13 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.499 HD21 HD22 ' A' ' 100' ' ' ASN . 0.3 OUTLIER -65.6 -23.81 66.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.441 -0.948 . . . . 1.13 108.441 178.21 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.37 -48.62 32.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.877 -1.056 . . . . 1.99 110.309 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.2 t -66.59 -34.78 78.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.84 -0.618 . . . . 1.87 110.86 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.448 ' O ' HG13 ' A' ' 131' ' ' ILE . 67.5 m -62.44 -45.7 91.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.941 -0.572 . . . . 1.66 111.157 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.458 HG13 HG22 ' A' ' 43' ' ' THR . 46.1 t -60.52 -54.86 29.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 1.29 111.51 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -50.51 -38.94 47.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.96 -0.563 . . . . 3.15 111.39 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.09 -56.02 23.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.971 -0.558 . . . . 2.1 112.46 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 127' ' ' SER . 0.1 OUTLIER -52.36 -55.31 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.681 0.277 . . . . 1.11 111.13 -178.743 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.432 ' HB2' ' NE2' ' A' ' 136' ' ' GLN . 54.4 p -53.73 -47.42 70.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 1.44 111.004 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -53.01 -29.58 30.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.38 -0.373 . . . . 0.37 111.752 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.9 mt -79.3 -51.42 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.837 0.68 . . . . 1.08 112.837 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.482 HG23 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -57.57 -45.55 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.518 0.562 . . . . 1.01 112.518 -178.709 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . 0.432 ' NE2' ' HB2' ' A' ' 132' ' ' SER . 45.4 mt-30 . . . . . 0 C--N 1.321 -0.673 0 CA-C-N 116.465 -0.334 . . . . 0.91 111.737 -178.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.855 0.359 . . . . 4.63 110.864 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.45 -112.96 4.58 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.933 -0.651 . . . . 2.94 112.105 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -135.71 12.27 3.43 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.916 0.389 . . . . 2.71 111.043 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.453 HG21 ' HB2' ' A' ' 77' ' ' TYR . 49.6 mm 64.76 98.65 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.624 -0.717 . . . . 1.08 111.918 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.4 p -131.75 -172.44 2.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 1.13 109.898 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.505 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -66.08 -33.55 76.04 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.541 -0.464 . . . . 1.55 110.073 179.404 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.78 -45.9 94.77 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 0.18 111.316 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.4 t -67.91 -39.97 82.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.657 0.741 . . . . 1.93 109.525 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -43.28 95.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.619 -1.173 . . . . 1.05 110.852 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.477 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 23.8 mt -60.98 -48.8 80.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.763 0.316 . . . . 1.08 110.543 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.69 -33.25 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.24 110.366 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.44 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 46.0 m -76.87 -35.41 57.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.96 111.47 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.503 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -71.8 -33.39 68.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.971 0.415 . . . . 1.08 110.838 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -77.22 -48.88 16.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.02 -0.536 . . . . 1.52 110.776 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.93 -46.99 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.139 -0.482 . . . . 1.07 110.974 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.48 HD11 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.91 -38.44 79.58 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.306 -0.406 . . . . 1.04 110.247 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.48 ' N ' HD11 ' A' ' 46' ' ' LEU . 7.8 t -55.52 -35.68 65.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.004 0.431 . . . . 1.15 109.847 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.18 -34.21 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.826 -0.624 . . . . 1.95 109.834 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.32 -35.4 73.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.232 -0.655 . . . . 1.03 109.232 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.493 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.5 mt -72.11 -33.71 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.701 -0.852 . . . . 1.02 108.701 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -74.37 -12.82 60.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.041 -0.982 . . . . 1.01 109.6 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.488 ' C ' ' H ' ' A' ' 54' ' ' SER . 13.5 ttm180 -86.22 -20.02 29.12 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.364 -0.834 . . . . 3.48 110.98 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -71.44 12.13 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 1.88 111.089 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.488 ' H ' ' C ' ' A' ' 52' ' ' ARG . 47.3 t -127.42 -24.97 3.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 2.69 110.274 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -69.18 -27.96 65.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.843 -0.617 . . . . 3.68 111.136 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.582 HE22 ' HB1' ' A' ' 58' ' ' ALA . 0.1 OUTLIER -178.08 41.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.122 -0.49 . . . . 4.31 110.804 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.1 mtt 74.74 -37.56 0.36 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.641 -0.709 . . . . 4.12 112.104 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.582 ' HB1' HE22 ' A' ' 56' ' ' GLN . . . 50.45 -117.08 1.01 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.84 -0.164 . . . . 1.92 111.225 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 95.2 p -174.47 135.43 0.42 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.739 0.304 . . . . 2.47 110.95 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -67.09 -23.04 65.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.204 -0.453 . . . . 1.87 109.887 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.5 m -76.9 -3.22 37.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.754 -0.657 . . . . 2.05 110.848 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.73 -53.73 5.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.094 0.473 . . . . 1.12 109.891 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.493 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -69.64 -28.97 39.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 1.13 109.701 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.593 HD21 ' NE2' ' A' ' 105' ' ' GLN . 0.6 OUTLIER -72.23 -53.42 12.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.841 -1.072 . . . . 1.13 110.98 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.37 -49.37 78.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.302 0.572 . . . . 2.32 109.894 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.24 -27.32 67.12 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.368 -0.975 . . . . 1.01 108.368 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -61.75 -47.54 89.71 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.746 -1.116 . . . . 0.56 112.582 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.439 ' HD2' HD13 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -65.81 -41.36 91.97 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.574 0.226 . . . . 1.57 111.224 -179.535 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 72' ' ' SER . 19.7 m-80 -58.42 -43.16 88.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.91 0.386 . . . . 0.53 110.953 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.503 HD21 ' N ' ' A' ' 43' ' ' THR . 3.2 tm? -64.7 -50.21 67.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.977 -0.556 . . . . 2.06 111.133 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -56.52 -33.27 65.88 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.679 -0.86 . . . . 1.31 108.679 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 70.6 m -65.17 -50.6 65.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.012 -0.994 . . . . 1.45 111.001 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.41 ' HB3' HG22 ' A' ' 34' ' ' ILE . 11.5 m-85 -62.17 -43.64 98.39 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.363 -0.535 . . . . 0.46 111.639 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -51.19 70.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.263 -0.426 . . . . 1.54 110.896 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.36 -37.79 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 112.527 0.566 . . . . 1.13 112.527 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -86.4 -10.27 54.64 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.056 0.455 . . . . 1.51 110.866 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.453 ' HB2' HG21 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -91.91 -23.55 19.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.787 -0.642 . . . . 0.8 111.778 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.453 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.0 OUTLIER -72.81 -11.44 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.949 0.404 . . . . 1.54 111.574 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -71.9 -3.61 23.47 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 1.31 109.681 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -110.64 1.97 18.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.45 -0.795 . . . . 1.93 111.459 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.527 ' CG2' ' HB2' ' A' ' 87' ' ' LYS . 23.3 mm -66.31 115.78 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 120.528 -0.469 . . . . 1.39 110.172 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.525 ' O ' ' HG3' ' A' ' 84' ' ' MET . 0.2 OUTLIER -84.67 -29.11 25.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 121.087 0.47 . . . . 2.55 110.099 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.665 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 15.0 mm100 -46.52 -47.08 19.55 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.26 -0.882 . . . . 3.3 113.101 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 43.3 mtm 81.91 -91.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.763 0.653 . . . . 3.25 112.763 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -64.75 0.92 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.886 0.374 . . . . 3.42 111.736 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.665 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -114.61 -17.97 11.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.067 -0.716 . . . . 2.49 109.067 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.527 ' HB2' ' CG2' ' A' ' 81' ' ' ILE . 0.6 OUTLIER -58.77 -35.65 73.11 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.173 -0.921 . . . . 2.88 109.289 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.469 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 71.1 m-85 -56.98 -44.25 82.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.574 -0.739 . . . . 3.08 110.026 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -53.77 -61.82 2.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 1.17 112.085 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.459 ' O ' HG13 ' A' ' 94' ' ' ILE . 66.9 t80 -63.23 -45.59 90.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.39 111.559 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.2 OUTLIER -58.15 -52.44 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 3.9 111.723 -178.139 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 11.0 pt-20 -54.94 -36.46 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.192 -0.299 . . . . 2.58 110.192 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.06 -40.03 88.09 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.665 0.745 . . . . 0.96 109.123 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 90' ' ' PHE . 32.9 mt -61.81 -41.2 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.174 -0.921 . . . . 1.09 109.018 178.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.619 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.51 -39.11 79.18 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.589 -1.187 . . . . 0.33 109.292 179.422 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.619 ' HD2' HD21 ' A' ' 95' ' ' ASN . 1.3 mptm? -54.4 -47.5 72.67 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.752 -0.462 . . . . 2.3 109.752 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.562 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 33.7 tp -59.95 -32.27 70.64 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.631 -0.427 . . . . 1.29 110.197 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -58.64 -60.14 4.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.144 -0.48 . . . . 1.87 110.736 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.437 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 0.9 OUTLIER -73.57 -10.22 59.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 2.12 111.474 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.447 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.9 -47.86 19.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.723 -0.843 . . . . 0.42 108.723 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 8.2 mt -66.42 -31.92 72.97 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.234 -0.894 . . . . 1.23 108.659 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.437 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 87.1 mtt180 -54.69 -55.76 26.41 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.092 -0.958 . . . . 2.63 110.764 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -71.89 -18.99 62.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.979 0.418 . . . . 2.32 110.495 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.459 HD11 ' CE2' ' A' ' 121' ' ' PHE . 32.9 tp -79.53 -18.18 52.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.941 -0.572 . . . . 1.08 111.225 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.593 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -52.18 -95.44 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.483 -0.326 . . . . 2.04 111.322 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.482 ' H ' ' HB3' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -145.76 -48.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.45 -0.341 . . . . 2.22 111.359 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.427 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.0 OUTLIER 66.78 154.44 0.13 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.233 -0.44 . . . . 2.44 111.158 179.659 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -47.68 -67.75 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.641 2.227 . . . . 3.01 112.779 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -166.79 1.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.587 -0.279 . . . . 4.42 111.383 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.3 m -53.64 -46.54 70.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 5.66 111.156 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.25 -72.12 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 5.83 111.02 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.88 107.93 0.9 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.849 -0.691 . . . . 5.65 112.322 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 79.2 p -79.1 -10.01 59.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 4.62 111.075 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 152.86 -78.55 0.2 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.771 -0.728 . . . . 4.88 112.877 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.46 -62.73 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.56 2.174 . . . . 6.39 112.582 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.63 121.02 15.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.454 . . . . 4.3 111.31 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -104.46 -56.94 2.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.224 -0.444 . . . . 3.13 110.831 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.6 p 54.47 107.83 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.423 0.63 . . . . 2.58 111.444 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -121.83 83.65 2.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.279 -0.873 . . . . 2.53 111.159 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.5 81.59 1.81 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.496 -0.775 . . . . 2.16 109.72 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.5 m-30 -85.02 43.1 0.98 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.61 111.733 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.469 ' HB2' ' HZ2' ' A' ' 123' ' ' LYS . 31.0 m -71.64 -14.28 62.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.938 -0.305 . . . . 1.78 110.605 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.469 ' HZ2' ' HB2' ' A' ' 122' ' ' SER . 0.1 OUTLIER -69.64 -44.21 71.06 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.198 -0.668 . . . . 3.05 109.198 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.483 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.1 OUTLIER -59.61 -25.44 64.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.376 -0.829 . . . . 1.13 108.771 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tp -73.88 -48.19 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.134 -0.939 . . . . 1.99 110.636 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.5 t -63.91 -35.82 81.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.131 -0.486 . . . . 1.87 111.123 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.416 ' O ' HG13 ' A' ' 131' ' ' ILE . 65.6 m -65.58 -46.74 78.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.541 . . . . 1.66 111.91 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.89 -55.43 23.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 1.29 111.537 -178.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -50.61 -40.68 53.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.764 -0.653 . . . . 3.15 111.017 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.5 -55.31 36.64 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.837 -0.62 . . . . 2.1 112.061 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.418 ' H ' HG13 ' A' ' 131' ' ' ILE . 0.1 OUTLIER -50.24 -56.14 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 120.735 0.303 . . . . 1.11 111.157 -178.857 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 30.7 t -56.61 -47.6 79.27 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.262 -0.426 . . . . 1.44 110.758 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.634 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 17.3 t70 -50.18 -26.73 4.91 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.922 -0.581 . . . . 0.37 112.28 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.1 mt -86.29 -51.21 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 113.131 0.789 . . . . 1.08 113.131 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.505 HG21 ' HG3' ' A' ' 36' ' ' LYS . 1.4 p -53.98 -47.56 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 113.897 1.073 . . . . 1.01 113.897 -177.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . 0.577 ' HB2' ' NH2' ' A' ' 137' ' ' ARG . 37.3 mt-30 -60.15 -37.82 81.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.636 -0.426 . . . . 0.91 111.709 -178.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.701 ' HE ' ' N ' ' A' ' 137' ' ' ARG . 0.0 OUTLIER -94.51 28.91 2.42 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.628 -0.878 . . . . 4.93 108.628 178.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.48 ' HG ' ' HG3' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -132.16 -35.63 1.19 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.278 -1.328 . . . . 2.5 111.082 -178.108 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 139' ' ' GLU . 8.4 pt-20 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.543 -0.742 . . . . 4.17 111.013 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.95 0.405 . . . . 4.63 110.616 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.81 -114.08 4.57 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.007 -0.616 . . . . 2.94 111.903 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.18 18.78 2.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 2.71 110.862 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.635 ' HA ' HG12 ' A' ' 38' ' ' VAL . 47.4 mm 64.83 106.69 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.514 -0.766 . . . . 1.08 111.814 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.479 ' O ' HG13 ' A' ' 38' ' ' VAL . 81.2 p -123.45 -160.27 0.9 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.427 -0.806 . . . . 1.13 109.179 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.715 ' HD3' HG22 ' A' ' 135' ' ' VAL . 6.5 ttpt -69.78 -39.97 76.3 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.206 -0.597 . . . . 1.55 109.426 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -52.18 -49.6 49.5 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.251 -0.886 . . . . 0.18 112.861 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -65.82 -38.67 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.606 0.717 . . . . 1.93 109.565 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.483 ' N ' HG11 ' A' ' 38' ' ' VAL . 1.3 t -62.64 -38.11 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.578 -1.192 . . . . 1.05 111.181 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.403 ' HA ' ' HG1' ' A' ' 43' ' ' THR . 20.0 mt -68.18 -51.41 46.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.062 -0.347 . . . . 1.08 110.062 178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.48 -31.02 21.97 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.315 -0.624 . . . . 0.24 109.315 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.2 m -73.96 -44.33 55.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.301 -0.863 . . . . 0.96 110.7 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.436 HG22 HD11 ' A' ' 70' ' ' LEU . 3.6 p -60.2 -37.7 81.04 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 120.865 0.364 . . . . 1.08 111.049 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.46 -52.91 27.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 1.52 111.29 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.12 -47.11 34.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 1.07 111.572 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.638 HD23 HD21 ' A' ' 70' ' ' LEU . 4.0 pp -74.91 -40.26 60.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.45 -0.341 . . . . 1.04 110.742 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.418 ' N ' HD13 ' A' ' 46' ' ' LEU . 44.1 t -55.46 -39.96 71.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.048 0.451 . . . . 1.15 110.276 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -70.3 -35.01 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 1.95 109.948 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.04 81.38 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.702 -0.481 . . . . 1.03 109.702 178.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.604 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.0 mt -70.72 -30.18 41.04 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 N-CA-C 108.785 -0.82 . . . . 1.02 108.785 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -79.15 -13.8 59.5 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.117 -0.947 . . . . 1.01 109.649 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.479 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . 47.4 mtp180 -92.62 -15.93 26.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.375 -0.829 . . . . 3.48 111.439 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.416 ' HA ' ' HB1' ' A' ' 58' ' ' ALA . 6.6 t-20 -79.44 14.54 1.55 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.88 111.087 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 43.5 t -102.17 -14.25 17.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.251 -0.431 . . . . 2.69 110.973 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -102.02 6.8 41.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.381 . . . . 3.68 111.125 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 58.62 29.15 18.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.028 -0.533 . . . . 4.31 111.329 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 62.8 mtt -124.93 -0.56 7.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.386 -0.37 . . . . 4.12 110.789 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 52' ' ' ARG . . . -102.23 -140.58 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 1.92 111.103 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.6 t -175.73 140.29 0.44 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.376 -0.375 . . . . 2.47 110.726 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -65.51 -18.84 65.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.26 -0.427 . . . . 1.87 109.861 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -78.08 -10.88 59.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.729 -0.669 . . . . 2.05 110.27 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.28 -45.94 24.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 1.12 110.206 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.604 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.13 -29.55 21.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 1.13 109.896 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.606 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.2 tm? -74.35 -51.24 15.67 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.992 -1.004 . . . . 1.13 111.18 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.31 -49.47 71.62 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.154 0.502 . . . . 2.32 109.799 179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.96 -27.41 67.44 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.258 -1.015 . . . . 1.01 108.258 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -65.08 -46.42 88.63 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.795 -1.093 . . . . 0.56 112.253 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.28 -43.94 98.04 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.847 0.356 . . . . 1.57 110.559 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -58.44 -41.95 86.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.53 111.033 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.638 HD21 HD23 ' A' ' 46' ' ' LEU . 12.9 tp -61.52 -47.69 84.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.2 -0.455 . . . . 2.06 110.432 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.471 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 10.5 t80 -57.94 -35.42 71.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.933 -0.576 . . . . 1.31 110.228 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 53.1 p -80.23 -18.62 48.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 1.45 112.399 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -80.31 -44.44 19.55 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.326 -0.99 . . . . 0.46 108.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.454 ' HA ' ' HB3' ' A' ' 77' ' ' TYR . 3.8 m -68.99 -27.08 65.37 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.502 -0.772 . . . . 1.54 109.118 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.5 OUTLIER -66.14 -37.78 80.51 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.615 -0.721 . . . . 1.13 110.801 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.5 t -91.06 -9.66 44.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.996 0.426 . . . . 1.51 110.07 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.454 ' HB3' ' HA ' ' A' ' 74' ' ' CYS . 0.2 OUTLIER -90.77 -28.35 18.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.634 -0.712 . . . . 0.8 111.454 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.455 ' HA ' HG12 ' A' ' 81' ' ' ILE . 3.4 m -66.1 -11.39 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.96 0.409 . . . . 1.54 111.663 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -71.05 -2.9 17.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 1.31 110.811 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 57.4 p -119.19 3.56 11.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.977 -0.556 . . . . 1.93 111.924 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.69 HG21 HD22 ' A' ' 86' ' ' ASN . 11.9 mm -55.22 -33.06 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 111.956 0.354 . . . . 1.39 111.956 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.492 ' C ' ' NE2' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 61.96 -66.65 0.07 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.565 0.95 . . . . 2.55 113.565 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.515 ' O ' ' N ' ' A' ' 85' ' ' ARG . 9.5 mt-30 -46.03 -9.33 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.97 1.1 . . . . 3.3 113.97 -177.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.538 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 7.5 ptt? 48.43 -69.92 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.566 1.321 . . . . 3.25 114.566 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 83' ' ' GLN . 34.0 ttm180 -48.97 -40.87 32.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.568 0.622 . . . . 3.42 110.729 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.69 HD22 HG21 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -73.3 -28.2 61.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.692 -0.686 . . . . 2.49 110.631 179.237 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -56.72 -37.05 70.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.027 -0.533 . . . . 2.88 111.021 -179.336 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -57.03 -48.5 78.35 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.578 -0.449 . . . . 3.08 110.067 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.44 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.91 -65.6 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.955 -0.566 . . . . 1.17 111.875 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.551 ' O ' HG13 ' A' ' 94' ' ' ILE . 68.0 t80 -62.83 -47.4 83.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.535 0.569 . . . . 0.39 112.535 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.8 OUTLIER -57.99 -56.52 20.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.686 -0.233 . . . . 3.9 111.32 -177.446 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.7 pt-20 -52.38 -36.18 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.886 -0.413 . . . . 2.58 109.886 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.45 -38.91 88.92 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.366 -0.605 . . . . 0.96 109.366 178.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -62.26 -40.93 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 N-CA-C 108.724 -0.843 . . . . 1.09 108.724 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.589 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.65 -42.53 88.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.444 -1.253 . . . . 0.33 109.225 179.238 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.589 ' HD2' HD21 ' A' ' 95' ' ' ASN . 1.1 mptm? -52.92 -40.94 63.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.501 -0.555 . . . . 2.3 109.501 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.585 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 15.5 tp -65.3 -35.79 82.07 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.888 -0.596 . . . . 1.29 110.238 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -53.63 -61.37 2.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.076 0.465 . . . . 1.87 110.383 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 0.4 OUTLIER -63.35 -40.62 97.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.669 -0.696 . . . . 2.12 111.156 179.054 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.489 HD21 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -49.45 -45.56 46.8 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.957 0.408 . . . . 0.42 110.051 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 4.8 mt -68.27 -39.55 82.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.792 -0.64 . . . . 1.23 109.537 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 47.0 mtp180 -54.59 -48.48 72.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.237 -0.892 . . . . 2.63 111.307 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.84 -21.35 55.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.087 0.47 . . . . 2.32 110.19 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.582 HD23 HD23 ' A' ' 64' ' ' LEU . 22.2 tp -77.79 -11.92 59.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.632 -0.713 . . . . 1.08 110.916 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.606 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -57.11 -177.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.049 -0.523 . . . . 2.04 111.146 179.837 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.469 HG23 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -63.31 -49.06 84.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 2.22 110.459 -179.933 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.469 ' N ' HG23 ' A' ' 106' ' ' ILE . 9.1 p 25.64 95.72 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.298 0 N-CA-C 113.261 0.837 . . . . 2.44 113.261 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -64.95 -63.12 0.08 OUTLIER 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 123.329 2.686 . . . . 3.01 112.076 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 113' ' ' SER . . . -174.08 9.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.022 -0.536 . . . . 4.42 111.032 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -51.36 -41.49 60.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.006 -0.543 . . . . 5.66 111.269 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.62 -33.22 60.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 5.83 111.244 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 137.92 53.51 0.05 OUTLIER Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.736 -0.745 . . . . 5.65 112.566 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.46 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 49.1 m -109.18 173.63 6.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.901 0.381 . . . . 4.62 111.1 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -153.44 -75.45 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.835 -0.698 . . . . 4.88 112.646 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.36 -65.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.441 2.094 . . . . 6.39 112.4 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 53.61 84.37 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.317 -0.401 . . . . 4.3 111.067 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -149.72 -178.56 6.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 3.13 111.058 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 p 47.79 77.78 0.09 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.943 0.877 . . . . 2.58 110.71 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -80.51 83.9 6.22 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.921 -1.49 . . . . 2.53 111.103 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -119.86 83.67 2.08 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.961 -0.755 . . . . 2.16 108.961 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.436 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.5 OUTLIER -78.46 42.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.727 -0.67 . . . . 0.61 111.871 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 58.7 m -66.45 -15.26 63.2 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.837 -0.345 . . . . 1.78 110.221 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.41 -40.11 67.42 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.123 -0.695 . . . . 3.05 109.123 178.752 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 124' ' ' LEU . 1.7 tp -65.5 -15.97 63.2 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.895 -0.78 . . . . 1.13 108.895 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.81 -48.18 13.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.173 -0.922 . . . . 1.99 110.15 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.9 p -73.54 -29.36 62.4 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 1.87 110.741 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.0 t -69.32 -49.13 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.883 -0.599 . . . . 1.66 110.691 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -42.15 92.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 115.372 -0.831 . . . . 1.29 110.832 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -64.35 -33.9 76.9 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.878 -0.601 . . . . 3.15 110.404 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -59.59 -46.53 88.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.761 -0.654 . . . . 2.1 110.751 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -57.25 -55.65 19.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.923 0.392 . . . . 1.11 110.464 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' HG11 ' A' ' 135' ' ' VAL . 1.4 t -53.68 -42.74 68.27 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.911 -0.586 . . . . 1.44 110.809 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.77 -37.89 77.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.998 -0.546 . . . . 0.37 112.066 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.494 HG21 HH21 ' A' ' 137' ' ' ARG . 72.8 mt -64.46 -53.1 46.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 112.057 0.392 . . . . 1.08 112.057 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.715 HG22 ' HD3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.05 -40.8 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 N-CA-C 112.793 0.664 . . . . 1.01 112.793 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -55.1 -54.61 40.97 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.935 0.346 . . . . 0.91 111.935 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.494 HH21 HG21 ' A' ' 134' ' ' ILE . 0.0 OUTLIER -79.28 -14.65 58.88 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.253 0.549 . . . . 4.93 109.706 179.313 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 134' ' ' ILE . 0.6 OUTLIER -62.71 -74.57 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.275 -0.875 . . . . 2.5 111.357 -179.818 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.174 -0.917 . . . . 4.17 111.186 -179.841 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.457 ' OG ' HD13 ' A' ' 34' ' ' ILE . 87.2 p . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 121.017 0.437 . . . . 4.63 110.434 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -108.07 80.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.697 -0.683 . . . . 2.94 111.479 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 49.79 21.82 0.73 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.069 0.462 . . . . 2.71 111.523 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.642 ' HA ' HG13 ' A' ' 38' ' ' VAL . 47.1 mm 62.66 107.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.379 -0.828 . . . . 1.08 112.152 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.486 ' O ' HG11 ' A' ' 38' ' ' VAL . 72.0 p -124.02 -160.35 0.92 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.319 -0.855 . . . . 1.13 109.342 178.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.567 ' HG3' HG12 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -75.5 -27.14 58.67 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.467 -0.568 . . . . 1.55 109.467 178.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.64 -46.58 93.43 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.46 -0.791 . . . . 0.18 111.832 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.642 HG13 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -68.88 -36.03 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.688 0.756 . . . . 1.93 109.29 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.423 ' N ' HG12 ' A' ' 38' ' ' VAL . 1.5 t -63.26 -43.66 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.467 -1.242 . . . . 1.05 110.764 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.511 HD13 ' HE3' ' A' ' 36' ' ' LYS . 26.4 mt -61.73 -51.12 69.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.798 0.332 . . . . 1.08 110.254 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -54.64 -30.09 54.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.24 110.166 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.478 ' HB2' HD22 ' A' ' 70' ' ' LEU . 70.2 m -79.38 -36.79 38.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.624 -0.716 . . . . 0.96 111.456 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.487 ' N ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -71.33 -26.93 63.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.177 0.513 . . . . 1.08 109.802 178.698 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -80.85 -45.74 16.39 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.592 -0.731 . . . . 1.52 109.956 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.91 -47.26 52.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.928 -0.578 . . . . 1.07 111.043 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.512 HD11 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -72.66 -39.28 67.25 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.726 -0.39 . . . . 1.04 110.056 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.512 ' N ' HD11 ' A' ' 46' ' ' LEU . 51.9 t -54.2 -42.25 69.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.128 -0.487 . . . . 1.15 110.276 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -38.4 81.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.77 -0.65 . . . . 1.95 109.682 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.25 -28.97 63.42 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.107 -0.497 . . . . 1.03 109.803 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -75.88 -39.37 37.78 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 108.888 -0.782 . . . . 1.02 108.888 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.526 ' HA ' ' HG ' ' A' ' 54' ' ' SER . 9.1 t -73.13 -10.04 59.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.273 -0.876 . . . . 1.01 109.595 178.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -83.14 -20.81 34.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.159 -0.928 . . . . 3.48 110.437 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -103.78 6.28 36.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.893 -0.594 . . . . 1.88 110.957 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.526 ' HG ' ' HA ' ' A' ' 51' ' ' SER . 80.6 p -114.3 -41.18 3.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.341 -0.39 . . . . 2.69 111.432 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.502 ' HB2' HE22 ' A' ' 56' ' ' GLN . 21.3 mm-40 -88.09 -0.66 57.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.759 0.314 . . . . 3.68 110.794 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.502 HE22 ' HB2' ' A' ' 55' ' ' GLU . 0.4 OUTLIER -172.49 -139.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 4.31 110.15 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 79.6 mtp -132.61 108.46 9.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.694 0.283 . . . . 4.12 110.986 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -119.01 -102.72 0.42 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.261 -0.427 . . . . 1.92 111.139 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.9 t -173.75 135.12 0.5 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.845 0.355 . . . . 2.47 111.243 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -68.0 -21.56 65.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.129 -0.487 . . . . 1.87 109.755 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -75.08 -10.4 59.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.618 -0.719 . . . . 2.05 110.473 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.92 -48.41 14.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.044 -0.526 . . . . 1.12 110.098 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.455 ' CG2' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -73.17 -35.79 48.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.277 -0.638 . . . . 1.13 109.277 178.441 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.646 HD22 ' NE2' ' A' ' 105' ' ' GLN . 2.0 tm? -64.15 -54.9 26.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.037 -0.983 . . . . 1.13 110.689 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.08 -48.88 78.23 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.258 -0.428 . . . . 2.32 111.726 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.2 -25.1 65.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.066 -0.516 . . . . 1.01 110.893 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.418 ' HA2' ' CD2' ' A' ' 46' ' ' LEU . . . -83.55 -30.15 30.78 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.176 -1.011 . . . . 0.56 112.402 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.609 ' HD2' HD11 ' A' ' 101' ' ' LEU . 15.7 mmmt -63.99 -35.23 80.01 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.977 -1.12 . . . . 1.57 107.977 177.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -70.0 -43.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.479 -1.237 . . . . 0.53 109.9 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 43' ' ' THR . 3.4 tm? -59.08 -48.1 82.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.298 -0.864 . . . . 2.06 110.147 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.536 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 10.7 t80 -61.14 -33.25 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.908 -0.587 . . . . 1.31 109.64 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 t -73.29 -26.85 61.24 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.673 -0.694 . . . . 1.45 112.03 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -81.61 -43.55 18.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 119.725 -0.79 . . . . 0.46 109.452 -178.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.4 m -64.31 -43.8 93.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.704 -0.68 . . . . 1.54 109.672 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.536 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.93 -39.75 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.955 -0.566 . . . . 1.13 111.995 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.4 t -86.73 -11.21 51.78 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.997 -0.681 . . . . 1.51 110.441 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.441 ' HB2' HG23 ' A' ' 34' ' ' ILE . 0.6 OUTLIER -90.68 -23.96 20.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.755 -0.657 . . . . 0.8 112.146 -179.395 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.459 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.6 m -70.28 -8.4 10.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.182 0.515 . . . . 1.54 111.221 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -74.77 -0.99 20.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.861 -0.609 . . . . 1.31 110.357 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 80.2 p -114.05 4.79 15.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.962 -0.563 . . . . 1.93 111.325 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 78' ' ' VAL . 25.0 mm -70.4 92.88 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 116.474 -0.33 . . . . 1.39 111.197 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.56 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -59.81 -34.76 73.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.781 -0.822 . . . . 2.55 108.781 178.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.616 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 1.6 mp0 -60.82 172.14 1.02 Allowed 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 114.905 -1.043 . . . . 3.3 109.969 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.4 ' C ' ' H ' ' A' ' 86' ' ' ASN . 4.9 ptm -144.06 -43.77 0.26 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.326 -0.397 . . . . 3.25 111.335 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -81.99 9.69 7.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.665 0.745 . . . . 3.42 109.045 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.616 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -126.89 -32.51 2.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.587 -1.188 . . . . 2.49 110.041 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -50.65 -44.63 57.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.387 -0.824 . . . . 2.88 111.067 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.52 ' N ' ' HD2' ' A' ' 87' ' ' LYS . 2.2 p90 -56.89 -46.8 81.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.4 0.619 . . . . 3.08 110.219 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.486 ' N ' ' CG ' ' A' ' 88' ' ' PHE . . . -52.77 -59.7 4.17 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.949 -1.023 . . . . 1.17 112.193 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.514 ' O ' HG13 ' A' ' 94' ' ' ILE . 68.8 t80 -66.13 -48.09 71.96 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.263 0.468 . . . . 0.39 112.263 -179.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -56.61 -52.92 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.462 -0.335 . . . . 3.9 110.795 -177.728 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.5 pt-20 -55.52 -36.87 67.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 2.58 110.382 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.2 -39.25 85.88 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.433 0.635 . . . . 0.96 109.731 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 90' ' ' PHE . 21.2 mt -62.63 -40.97 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.404 0 CA-C-N 115.357 -0.838 . . . . 1.09 108.806 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.579 ' ND2' ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.51 -40.83 83.97 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.497 -1.229 . . . . 0.33 109.186 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.579 ' HD2' ' ND2' ' A' ' 95' ' ' ASN . 11.0 mptt -51.95 -49.89 62.26 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.374 -0.375 . . . . 2.3 110.133 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.518 ' HG ' HD12 ' A' ' 101' ' ' LEU . 30.7 tp -58.44 -32.25 68.53 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 116.079 -0.51 . . . . 1.29 110.606 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.59 -60.08 4.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.373 -0.376 . . . . 1.87 110.495 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -72.59 -10.04 59.31 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.119 -0.491 . . . . 2.12 111.587 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.46 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.72 -43.95 21.68 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.37 -0.974 . . . . 0.42 108.37 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.609 HD11 ' HD2' ' A' ' 68' ' ' LYS . 10.5 mt -68.11 -33.19 74.05 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.053 -0.976 . . . . 1.23 108.45 178.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -54.95 -55.55 29.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.854 -1.066 . . . . 2.63 110.534 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -71.76 -21.95 61.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.001 0.429 . . . . 2.32 110.575 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.558 HD23 HD21 ' A' ' 64' ' ' LEU . 29.3 tp -77.77 -17.99 56.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 1.08 111.339 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.646 ' NE2' HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -51.87 162.27 0.45 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.322 -0.399 . . . . 2.04 111.234 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.633 HG22 ' H ' ' A' ' 107' ' ' CYS . 0.7 OUTLIER -56.13 -66.9 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.265 -0.425 . . . . 2.22 111.517 -179.635 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.633 ' H ' HG22 ' A' ' 106' ' ' ILE . 11.2 t 67.82 144.48 0.1 OUTLIER Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.375 -0.375 . . . . 2.44 110.511 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.544 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 51.7 Cg_exo -53.23 -66.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.513 2.142 . . . . 3.01 112.84 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' A' ' 113' ' ' SER . . . -165.34 4.43 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.58 -0.282 . . . . 4.42 111.464 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.1 m -54.05 -30.71 49.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.369 -0.378 . . . . 5.66 111.245 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.42 29.14 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 5.83 111.261 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 129.59 -100.82 0.51 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.888 -0.673 . . . . 5.65 112.228 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 109' ' ' ALA . 45.6 t -170.93 -99.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.868 0.366 . . . . 4.62 111.259 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -140.9 -68.02 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.996 -0.621 . . . . 4.88 112.678 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.21 -57.13 0.53 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.445 2.097 . . . . 6.39 112.354 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -92.73 102.6 15.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 4.3 110.852 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -138.03 -35.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 3.13 111.5 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.4 p 56.32 104.19 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.455 0.645 . . . . 2.58 110.989 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -105.89 83.52 1.93 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.164 -0.926 . . . . 2.53 111.225 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -125.0 82.58 2.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.41 -0.814 . . . . 2.16 109.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.517 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.6 OUTLIER -80.05 42.66 0.57 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.86 -0.609 . . . . 0.61 111.951 -177.937 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 43.9 m -66.82 -15.91 63.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.917 -0.401 . . . . 1.78 109.917 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 123' ' ' LYS . 3.0 mppt? -70.89 -44.38 66.42 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.715 -0.846 . . . . 3.05 108.715 178.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.475 ' O ' HD11 ' A' ' 124' ' ' LEU . 1.4 tp -60.23 -22.1 62.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.463 -0.789 . . . . 1.13 108.945 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -48.81 29.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.258 -0.883 . . . . 1.99 109.872 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.1 m -67.12 -31.68 72.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.703 -0.681 . . . . 1.87 110.667 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.478 ' O ' HG13 ' A' ' 131' ' ' ILE . 68.6 m -66.98 -41.73 86.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 1.66 111.218 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.473 HG11 ' HB ' ' A' ' 43' ' ' THR . 26.2 t -63.42 -56.16 18.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.13 -0.486 . . . . 1.29 111.074 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.0 mmtt -52.67 -36.48 57.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.56 -0.746 . . . . 3.15 111.341 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.407 ' O ' HG13 ' A' ' 134' ' ' ILE . 40.3 tt0 -62.5 -51.61 66.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.106 -0.497 . . . . 2.1 112.278 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.498 ' H ' HG13 ' A' ' 131' ' ' ILE . 1.3 mt -55.23 -55.23 17.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 C-N-CA 120.942 -0.303 . . . . 1.11 110.96 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.1 p -55.21 -45.77 75.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 1.44 111.275 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.79 -31.29 58.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.37 111.739 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.611 HG21 HH21 ' A' ' 137' ' ' ARG . 91.1 mt -74.78 -51.25 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 112.877 0.695 . . . . 1.08 112.877 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.567 HG12 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.57 -41.62 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 112.296 0.48 . . . . 1.01 112.296 -179.056 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -55.1 -31.96 61.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.309 -0.405 . . . . 0.91 111.848 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.611 HH21 HG21 ' A' ' 134' ' ' ILE . 3.3 mtm180 -99.46 -17.2 18.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.404 0.621 . . . . 4.93 109.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 135' ' ' VAL . 4.2 tt -58.75 -89.13 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.083 -0.962 . . . . 2.5 110.664 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.45 ' H ' ' HB3' ' A' ' 138' ' ' LEU . 45.0 mt-10 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.259 -0.876 . . . . 4.17 110.951 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.853 0.359 . . . . 4.63 110.644 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.24 40.58 49.15 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 2.94 111.961 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 46.76 23.44 0.25 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.115 0.413 . . . . 2.71 112.115 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.638 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.0 mm 63.7 111.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.757 -0.656 . . . . 1.08 112.065 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.54 ' O ' HG12 ' A' ' 38' ' ' VAL . 77.5 p -129.55 -159.42 0.96 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.291 -0.868 . . . . 1.13 109.483 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.49 ' HB2' HG23 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.3 -30.86 60.49 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.384 -0.527 . . . . 1.55 109.733 178.463 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.443 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -60.85 -46.14 95.12 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.539 -0.755 . . . . 0.18 112.046 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.638 HG11 ' HA ' ' A' ' 34' ' ' ILE . 10.8 p -66.97 -39.3 83.14 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 1.93 109.522 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.445 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -63.23 -43.38 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 114.825 -1.079 . . . . 1.05 110.876 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.481 HD23 ' HG ' ' A' ' 132' ' ' SER . 36.2 mt -63.11 -46.85 85.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.71 0.29 . . . . 1.08 110.521 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.9 -32.63 67.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.966 0.412 . . . . 0.24 110.224 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.458 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 39.3 m -77.47 -35.45 53.79 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.747 -0.661 . . . . 0.96 111.371 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.469 ' OG1' ' HA ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -73.31 -26.6 61.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.509 . . . . 1.08 109.816 178.545 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -79.11 -47.26 16.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.509 -0.769 . . . . 1.52 110.161 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.51 -47.29 63.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.054 -0.521 . . . . 1.07 111.024 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.529 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.2 pp -69.97 -40.28 75.48 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.821 -0.352 . . . . 1.04 110.182 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.51 ' N ' HD13 ' A' ' 46' ' ' LEU . 53.9 t -57.31 -41.69 80.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.043 -0.526 . . . . 1.15 110.889 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mp -65.88 -39.86 91.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 1.95 110.238 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.84 -39.65 71.71 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.78 -0.452 . . . . 1.03 109.78 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -70.12 -38.5 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.228 0 N-CA-C 108.902 -0.777 . . . . 1.02 108.902 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -71.14 -14.55 62.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 1.01 109.18 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.586 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . 15.5 mtp180 -91.94 -18.55 23.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.266 -0.879 . . . . 3.48 111.137 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -95.54 3.13 54.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.101 -0.5 . . . . 1.88 110.707 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -115.11 -29.28 6.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.271 -0.422 . . . . 2.69 111.255 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.411 ' HB2' ' NE2' ' A' ' 56' ' ' GLN . 13.6 mm-40 -108.58 -15.26 14.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 3.68 110.666 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.465 ' NE2' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -141.31 -147.68 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.871 -0.604 . . . . 4.31 110.015 179.839 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.8 mtp -136.53 70.13 1.41 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.413 -0.358 . . . . 4.12 110.897 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.586 ' HB3' ' HB3' ' A' ' 52' ' ' ARG . . . -80.56 -101.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 1.92 110.86 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.3 t -172.39 136.76 0.81 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.266 0.555 . . . . 2.47 112.086 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -68.05 -29.45 68.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.351 -0.841 . . . . 1.87 110.013 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -77.61 -5.11 49.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 2.05 111.17 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.97 -48.98 10.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.973 0.416 . . . . 1.12 110.515 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.509 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -68.05 -39.48 81.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.826 -0.624 . . . . 1.13 110.258 179.334 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.602 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.1 tm? -65.02 -56.06 15.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.442 -0.799 . . . . 1.13 111.224 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.14 -44.04 95.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.342 -0.39 . . . . 2.32 111.596 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.63 -45.71 85.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.041 -0.527 . . . . 1.01 111.063 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.439 ' HA2' ' CD2' ' A' ' 46' ' ' LEU . . . -62.87 -31.36 80.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.335 -0.936 . . . . 0.56 112.578 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.494 ' HZ1' HE22 ' A' ' 105' ' ' GLN . 1.0 OUTLIER -63.07 -44.31 96.14 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.464 -0.939 . . . . 1.57 108.464 177.503 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -62.68 -38.63 91.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.61 -1.177 . . . . 0.53 110.341 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.458 ' CD2' ' HB2' ' A' ' 42' ' ' SER . 2.8 tm? -65.77 -49.97 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.472 -0.785 . . . . 2.06 111.069 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -53.6 -34.88 59.99 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.735 -0.839 . . . . 1.31 108.735 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.0 m -68.46 -49.67 58.14 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.042 -0.981 . . . . 1.45 111.444 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -57.25 -43.57 83.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.92 -0.712 . . . . 0.46 110.581 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.422 ' O ' HG13 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -60.74 -29.33 69.31 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.766 -0.652 . . . . 1.54 109.838 178.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -37.13 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.489 -0.778 . . . . 1.13 111.36 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.3 t -89.59 -9.03 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 1.51 110.977 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.454 ' HB2' HG21 ' A' ' 34' ' ' ILE . 1.6 t80 -94.63 -29.6 14.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.0 -0.545 . . . . 0.8 111.614 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.448 ' O ' HG12 ' A' ' 81' ' ' ILE . 3.6 m -61.65 -11.92 6.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.148 0.499 . . . . 1.54 111.034 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -80.19 8.67 6.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.769 -0.65 . . . . 1.31 109.877 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 58.5 m -117.53 -8.99 10.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.694 -0.685 . . . . 1.93 110.693 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.474 HG23 ' HG3' ' A' ' 87' ' ' LYS . 34.6 mm -56.91 106.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 116.106 -0.497 . . . . 1.39 110.869 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.656 HE21 ' C ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER -67.93 -48.39 66.09 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.936 0.398 . . . . 2.55 110.133 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.562 ' HB2' ' ND2' ' A' ' 86' ' ' ASN . 28.7 mt-30 -59.31 -174.55 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.77 -0.65 . . . . 3.3 109.955 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -152.46 -40.34 0.11 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.349 -0.54 . . . . 3.25 111.582 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -73.78 -1.9 21.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.642 0.734 . . . . 3.42 109.052 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.588 ' ND2' ' N ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -115.65 -25.57 7.79 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.943 -1.026 . . . . 2.49 110.611 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.588 ' N ' ' ND2' ' A' ' 86' ' ' ASN . 1.0 OUTLIER -45.47 -48.93 13.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.798 -0.637 . . . . 2.88 111.083 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -56.2 -43.0 78.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.793 -0.64 . . . . 3.08 110.75 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -55.24 -61.24 2.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.271 0.471 . . . . 1.17 112.271 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.557 ' O ' HG13 ' A' ' 94' ' ' ILE . 88.9 t80 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.195 0.442 . . . . 0.39 112.195 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.06 -55.03 31.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 3.9 110.654 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.4 pt-20 -58.55 -34.3 70.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 2.58 110.564 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -59.99 -37.99 81.29 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.494 0.664 . . . . 0.96 109.823 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.0 mt -66.11 -36.22 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 115.336 -0.847 . . . . 1.09 109.123 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.623 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -61.74 -32.09 72.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.86 -1.063 . . . . 0.33 109.22 179.115 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.623 ' HD2' HD21 ' A' ' 95' ' ' ASN . 0.7 OUTLIER -63.89 -48.67 75.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.526 -0.546 . . . . 2.3 109.526 178.581 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.559 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 23.5 tp -58.11 -33.59 69.29 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 116.165 -0.47 . . . . 1.29 109.951 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.491 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 7.5 tp10 -57.75 -59.24 5.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.892 -0.594 . . . . 1.87 110.424 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.568 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 29.3 m-80 -72.75 -9.93 59.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 2.12 111.181 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.463 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -78.41 -47.94 16.51 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 108.683 -0.858 . . . . 0.42 108.683 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 5.9 mt -65.5 -34.44 78.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.323 -0.991 . . . . 1.23 108.323 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 98.2 mtt180 -55.49 -50.03 70.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.942 -1.026 . . . . 2.63 111.256 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.75 -22.13 50.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.106 0.479 . . . . 2.32 110.136 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.547 HD23 HD23 ' A' ' 64' ' ' LEU . 42.0 tp -69.37 -17.31 63.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.721 -0.672 . . . . 1.08 110.83 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.602 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -48.26 130.2 15.98 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.769 0.319 . . . . 2.04 110.517 179.912 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.481 HG21 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -56.18 -53.09 43.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 2.22 111.307 -179.012 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.481 ' N ' HG21 ' A' ' 106' ' ' ILE . 13.3 t 179.07 140.19 0.28 Allowed Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 120.542 0.21 . . . . 2.44 110.847 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.405 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 39.4 Cg_exo -57.56 -37.77 95.99 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.44 2.093 . . . . 3.01 111.467 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.576 ' HA ' ' HB2' ' A' ' 113' ' ' SER . . . 72.46 2.35 4.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.739 -1.119 . . . . 4.42 111.077 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.0 m -80.72 -27.37 36.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.026 -0.534 . . . . 5.66 110.838 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -86.76 -67.5 0.81 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.92 -0.582 . . . . 5.83 111.364 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -152.49 -27.57 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.693 -0.765 . . . . 5.65 112.854 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.576 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 47.9 t 63.9 164.11 0.13 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.979 0.418 . . . . 4.62 111.407 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . 0.446 ' H ' ' HG ' ' A' ' 113' ' ' SER . . . 164.81 142.18 3.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.812 -0.708 . . . . 4.88 112.335 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 105.97 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 6.39 112.216 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -71.57 -43.31 66.56 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 4.3 111.389 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . 61.51 -174.42 0.13 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.352 -0.385 . . . . 3.13 111.345 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 43.3 p 47.42 75.98 0.12 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.99 0.9 . . . . 2.58 110.971 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -87.51 84.88 7.08 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.822 -1.535 . . . . 2.53 111.309 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -104.71 81.51 1.78 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.293 -0.632 . . . . 2.16 109.293 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.443 ' HB2' HG22 ' A' ' 50' ' ' ILE . 2.0 m-30 -104.38 42.47 1.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.61 112.234 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 96.4 p -73.18 -17.15 61.4 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.702 -0.481 . . . . 1.78 109.702 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.459 ' HA ' ' HD2' ' A' ' 123' ' ' LYS . 29.8 mmmt -66.83 -52.61 41.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 109.135 -0.691 . . . . 3.05 109.135 178.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.8 OUTLIER -51.41 -27.04 9.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.001 -0.999 . . . . 1.13 109.049 177.544 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.46 -49.71 38.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.266 -0.879 . . . . 1.99 110.214 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 89.7 p -64.43 -34.26 77.78 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.903 -0.59 . . . . 1.87 111.128 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 t -62.31 -46.88 86.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 1.66 111.529 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.401 HG13 ' HB ' ' A' ' 43' ' ' THR . 53.8 t -60.87 -50.23 81.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 1.29 111.311 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -50.71 -43.82 57.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.035 -0.53 . . . . 3.15 110.92 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.407 ' O ' HG13 ' A' ' 134' ' ' ILE . 10.9 tp10 -59.26 -55.47 34.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.638 -0.71 . . . . 2.1 112.79 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -51.36 -55.07 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-O 120.826 0.346 . . . . 1.11 111.299 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.481 ' HG ' HD23 ' A' ' 40' ' ' LEU . 41.2 t -53.61 -48.4 69.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.11 -0.496 . . . . 1.44 111.048 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.87 -29.84 30.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.103 0.408 . . . . 0.37 112.103 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.518 HG23 ' NH2' ' A' ' 137' ' ' ARG . 65.7 mt -76.8 -51.31 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 113.012 0.745 . . . . 1.08 113.012 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.525 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . 0.1 OUTLIER -58.03 -44.9 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.536 0.939 . . . . 1.01 113.536 -178.172 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -44.18 -40.58 5.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.825 0.676 . . . . 0.91 112.825 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.518 ' NH2' HG23 ' A' ' 134' ' ' ILE . 9.9 mtm180 -84.31 -25.15 29.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.317 0.579 . . . . 4.93 109.911 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.525 ' HB3' ' HA ' ' A' ' 135' ' ' VAL . 0.5 OUTLIER -69.06 -63.96 0.96 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.061 -0.972 . . . . 2.5 110.811 179.695 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.447 ' N ' HD12 ' A' ' 138' ' ' LEU . 40.6 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.138 -0.934 . . . . 4.17 111.399 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.762 0.315 . . . . 4.63 111.277 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 57.98 28.58 61.06 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.749 -0.739 . . . . 2.94 112.494 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 47.31 19.76 0.13 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.528 0.566 . . . . 2.71 112.528 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.443 HG23 ' HB2' ' A' ' 77' ' ' TYR . 50.7 mm 58.88 97.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 1.08 111.954 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.7 p -127.95 -175.95 3.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.626 -0.715 . . . . 1.13 109.649 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.476 ' HG3' ' CG2' ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.74 -34.29 77.83 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.372 -0.531 . . . . 1.55 109.775 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.444 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.0 -43.71 98.8 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.676 -0.773 . . . . 0.18 111.2 178.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.1 t -69.08 -40.36 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.591 0.71 . . . . 1.93 109.559 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.26 -44.16 97.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.639 -1.164 . . . . 1.05 110.826 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.46 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 25.1 mt -60.58 -47.4 86.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.722 0.296 . . . . 1.08 110.602 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -56.35 -31.47 63.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.24 110.219 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.442 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 41.8 m -77.86 -34.85 51.53 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.761 -0.654 . . . . 0.96 111.277 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.489 ' N ' HD22 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -73.43 -29.14 62.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 1.08 109.805 178.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -79.23 -45.76 19.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.698 -0.683 . . . . 1.52 110.218 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.61 -47.19 63.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.043 -0.526 . . . . 1.07 110.786 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.536 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.4 pp -68.24 -39.97 82.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.526 -0.47 . . . . 1.04 110.055 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.513 ' N ' HD13 ' A' ' 46' ' ' LEU . 41.9 t -56.85 -41.45 77.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.211 -0.45 . . . . 1.15 110.756 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.71 -39.15 90.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 1.95 110.191 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.68 -34.11 69.07 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.408 -0.59 . . . . 1.03 109.408 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.564 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -72.17 -30.33 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 109.037 -0.727 . . . . 1.02 109.037 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -81.62 -13.16 58.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.158 -0.928 . . . . 1.01 109.689 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.52 ' C ' ' H ' ' A' ' 54' ' ' SER . 98.8 mtt180 -96.3 -17.03 20.99 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.599 -0.728 . . . . 3.48 111.205 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.712 ' HA ' ' H ' ' A' ' 58' ' ' ALA . 14.3 t-20 -66.96 11.85 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 1.88 111.522 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.52 ' H ' ' C ' ' A' ' 52' ' ' ARG . 54.3 m -139.02 -23.42 0.92 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.613 0.244 . . . . 2.69 111.13 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -76.03 -35.23 59.59 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.494 -0.321 . . . . 3.68 111.58 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.59 31.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.025 0.44 . . . . 4.31 110.88 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 84.1 mtp 60.07 96.67 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.613 -0.721 . . . . 4.12 111.681 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.712 ' H ' ' HA ' ' A' ' 53' ' ' ASN . . . -97.38 -20.8 17.57 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.043 -0.526 . . . . 1.92 110.532 179.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' A' ' 58' ' ' ALA . 66.3 m 80.38 141.07 0.07 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.099 0.874 . . . . 2.47 111.581 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' A' ' 105' ' ' GLN . 5.3 p-80 -63.51 -27.61 69.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.779 -0.646 . . . . 1.87 109.91 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.7 m -64.97 -10.21 27.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.9 -0.591 . . . . 2.05 110.48 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.36 -51.46 7.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.917 -0.583 . . . . 1.12 110.193 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.564 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -72.13 -34.23 49.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.58 -0.736 . . . . 1.13 109.709 178.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.542 ' HG ' ' HA ' ' A' ' 105' ' ' GLN . 2.2 tm? -64.87 -53.29 49.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.205 -0.907 . . . . 1.13 110.325 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.45 -45.36 91.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.863 -0.608 . . . . 2.32 111.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.0 74.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 1.01 111.288 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.427 ' HA2' ' CD2' ' A' ' 46' ' ' LEU . . . -75.88 -30.4 57.72 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.097 -1.049 . . . . 0.56 112.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.412 ' HZ2' ' HB3' ' A' ' 101' ' ' LEU . 1.6 tppt? -64.21 -40.3 95.78 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.36 -0.978 . . . . 1.57 108.36 177.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.2 m-80 -65.38 -39.23 91.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.626 -1.17 . . . . 0.53 109.918 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' ' 43' ' ' THR . 3.0 tm? -65.55 -49.82 67.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.312 -0.858 . . . . 2.06 110.824 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -56.52 -32.8 65.44 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.28 -1.007 . . . . 1.31 108.28 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 35.0 t -65.04 -50.28 66.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.99 -1.005 . . . . 1.45 110.773 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -63.11 -42.94 99.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.525 -0.47 . . . . 0.46 111.456 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -50.61 73.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.346 -0.388 . . . . 1.54 110.591 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.56 -36.68 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.981 -0.554 . . . . 1.13 112.384 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.2 t -88.28 -9.89 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.098 0.475 . . . . 1.51 110.502 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.443 ' HB2' HG23 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -90.14 -27.97 19.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.629 -0.714 . . . . 0.8 111.295 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HE2' ' A' ' 87' ' ' LYS . 1.2 m -69.24 -10.76 13.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.32 . . . . 1.54 111.422 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.96 -2.43 18.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.126 0.489 . . . . 1.31 110.021 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.4 t -111.61 -0.43 16.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.79 -0.641 . . . . 1.93 111.291 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.468 ' CG2' HD22 ' A' ' 86' ' ' ASN . 3.8 mm -54.99 103.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 109.839 -0.43 . . . . 1.39 109.839 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.627 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -72.17 -40.56 67.86 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.132 0.491 . . . . 2.55 109.786 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.69 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -58.99 178.54 0.11 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.487 -0.779 . . . . 3.3 109.401 179.297 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.528 ' H ' ' NE2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -136.39 -40.79 0.64 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.464 -0.494 . . . . 3.25 112.147 -178.23 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.592 ' HG2' HE22 ' A' ' 83' ' ' GLN . 18.9 ptp180 -88.88 33.09 0.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.349 0.595 . . . . 3.42 109.445 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.69 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -133.9 -33.68 1.04 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.237 -0.892 . . . . 2.49 111.035 -179.299 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.599 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 20.6 tptp -37.88 -55.22 1.22 Allowed 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.814 -0.63 . . . . 2.88 111.66 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.555 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 97.3 m-85 -56.05 -48.15 76.55 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.056 -0.52 . . . . 3.08 110.901 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.43 -66.29 0.42 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.83 0.347 . . . . 1.17 111.615 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.61 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.9 t80 -65.23 -49.1 70.97 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.995 0.739 . . . . 0.39 112.995 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.599 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 12.2 ttt180 -54.77 -64.1 0.94 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.061 0.393 . . . . 3.9 112.061 -176.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -51.6 -37.43 49.89 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.524 -0.547 . . . . 2.58 109.524 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 90' ' ' PHE . . . -56.92 -41.01 77.41 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.732 -0.667 . . . . 0.96 109.531 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -61.85 -39.12 82.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 108.951 -0.759 . . . . 1.09 108.951 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.622 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -60.4 -32.06 70.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.607 -1.179 . . . . 0.33 109.695 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.622 ' HD2' HD21 ' A' ' 95' ' ' ASN . 10.6 mptt -62.57 -49.21 76.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.688 -0.486 . . . . 2.3 109.688 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.547 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 27.7 tp -59.06 -34.24 71.72 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.634 -0.426 . . . . 1.29 110.135 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 8.0 tp10 -55.42 -57.66 10.96 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.031 -0.531 . . . . 1.87 110.185 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 45.6 m-80 -63.92 -40.02 95.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 2.12 111.123 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.534 HD21 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -51.05 -48.65 61.49 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.42 109.999 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 5.6 mt -67.25 -38.5 85.27 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.261 -0.644 . . . . 1.23 109.261 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.655 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 64.7 mtp180 -54.92 -37.59 66.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.275 -0.875 . . . . 2.63 111.473 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -90.59 -15.49 30.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.244 -0.434 . . . . 2.32 111.616 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.497 HD21 HD22 ' A' ' 64' ' ' LEU . 6.3 tp -87.3 -22.15 25.32 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.167 1.173 . . . . 1.08 114.167 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.77 HE21 ' H ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -61.56 -29.94 70.34 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.776 -0.37 . . . . 2.04 111.795 -178.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.57 HG23 ' OE1' ' A' ' 105' ' ' GLN . 0.3 OUTLIER -179.75 -52.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.303 0.483 . . . . 2.22 112.303 178.649 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.488 ' N ' ' CG2' ' A' ' 106' ' ' ILE . 53.1 t 67.1 142.38 0.08 OUTLIER Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.376 -0.375 . . . . 2.44 110.653 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.426 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 24.8 Cg_exo -63.37 -65.7 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.59 2.193 . . . . 3.01 112.392 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.27 -5.5 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.306 -0.406 . . . . 4.42 111.005 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 36.5 m -57.58 -31.93 66.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 5.66 111.25 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -155.0 116.35 4.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.261 -0.427 . . . . 5.83 111.395 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.58 82.91 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.914 -0.66 . . . . 5.65 112.536 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.4 m -64.79 -93.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.953 0.406 . . . . 4.62 111.239 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -75.63 -168.76 25.27 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.868 -0.605 . . . . 4.88 112.606 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.74 -13.4 32.17 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 122.222 1.948 . . . . 6.39 112.213 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -108.88 98.24 7.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.003 -0.544 . . . . 4.3 110.933 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -158.19 -61.31 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 3.13 111.146 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.9 t 177.14 108.83 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.812 -0.631 . . . . 2.58 111.114 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -93.8 83.7 4.45 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.244 -0.889 . . . . 2.53 110.652 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -140.6 81.19 1.79 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.215 -0.902 . . . . 2.16 109.609 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.403 ' CE2' HD12 ' A' ' 104' ' ' LEU . 3.1 m-30 -86.61 42.5 1.01 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 0.61 111.233 -178.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m -77.82 -14.28 59.62 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.855 -0.338 . . . . 1.78 110.449 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.475 ' HE3' ' HB2' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.8 -42.57 63.75 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.007 -0.738 . . . . 3.05 109.007 179.007 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.417 ' O ' HD11 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.25 -23.73 67.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.538 -0.912 . . . . 1.13 108.538 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.9 -48.47 30.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.858 -1.064 . . . . 1.99 110.089 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.7 t -63.05 -34.53 77.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.022 -0.535 . . . . 1.87 110.881 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 70.4 m -63.21 -48.64 77.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.968 -0.56 . . . . 1.66 111.502 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.4 HG11 ' HB ' ' A' ' 43' ' ' THR . 64.8 t -58.53 -52.89 54.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.864 0.364 . . . . 1.29 111.295 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -50.8 -42.26 57.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 3.15 111.271 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.6 tt0 -58.1 -56.11 26.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 2.1 112.265 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -50.89 -55.7 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 120.946 0.403 . . . . 1.11 111.111 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 40.0 t -54.03 -47.68 71.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.04 -0.527 . . . . 1.44 110.407 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.496 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 15.6 t70 -56.51 -20.28 19.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.37 111.858 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 130' ' ' GLU . 89.9 mt -89.15 -30.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.731 0.641 . . . . 1.08 112.731 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.476 ' CG2' ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -83.05 -50.94 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 114.665 1.358 . . . . 1.01 114.665 -177.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . 0.692 ' HB2' HH21 ' A' ' 137' ' ' ARG . 37.2 mt-30 -46.18 -68.82 0.16 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.338 0.866 . . . . 0.91 113.338 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.692 HH21 ' HB2' ' A' ' 136' ' ' GLN . 0.2 OUTLIER -76.32 35.15 0.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.052 0.454 . . . . 4.93 111.135 -179.663 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.467 ' H ' ' C ' ' A' ' 136' ' ' GLN . 1.0 OUTLIER -130.82 -55.84 1.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.022 -0.535 . . . . 2.5 110.808 -179.487 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.106 -0.95 . . . . 4.17 110.937 179.904 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.746 0.308 . . . . 4.63 111.065 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 71.45 -109.7 2.94 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.035 -0.602 . . . . 2.94 112.467 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.64 15.35 2.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.912 0.387 . . . . 2.71 111.148 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.8 mm 66.47 100.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.661 . . . . 1.08 111.91 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 p -127.64 -178.25 4.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.576 -0.738 . . . . 1.13 109.296 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.527 ' HB2' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -62.52 -37.71 87.1 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.2 -0.6 . . . . 1.55 110.014 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.512 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -57.75 -46.75 91.91 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.635 -0.793 . . . . 0.18 111.147 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.6 t -65.42 -38.48 82.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.508 0.671 . . . . 1.93 109.525 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.414 ' O ' HD23 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -62.26 -42.39 95.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 114.806 -1.088 . . . . 1.05 110.374 179.347 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.45 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 19.1 mt -60.92 -48.33 82.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.203 -0.453 . . . . 1.08 110.466 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.3 -28.85 63.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.079 0.466 . . . . 0.24 110.273 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.492 ' HB2' HD23 ' A' ' 70' ' ' LEU . 58.0 m -78.87 -35.48 43.68 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.705 -0.679 . . . . 0.96 110.926 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.45 ' OG1' ' HA ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -73.69 -26.97 60.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.208 0.528 . . . . 1.08 109.909 178.464 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -80.93 -50.03 10.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.532 -0.758 . . . . 1.52 109.922 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.3 -46.71 36.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.005 -0.543 . . . . 1.07 110.838 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.586 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.2 pp -69.87 -41.81 74.32 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.879 -0.415 . . . . 1.04 109.879 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.481 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.1 t -53.82 -45.59 70.86 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.222 -0.444 . . . . 1.15 110.949 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.98 -42.86 99.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.95 110.185 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.423 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . . . -55.14 -30.29 59.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.204 -0.453 . . . . 1.03 110.166 178.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.2 mt -74.64 -39.17 46.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.289 -0.634 . . . . 1.02 109.289 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.2 t -77.18 -10.22 59.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.232 -0.895 . . . . 1.01 109.951 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.463 ' HA ' ' NE2' ' A' ' 56' ' ' GLN . 69.4 mtm180 -94.33 -12.08 28.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.591 -0.731 . . . . 3.48 110.832 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.579 ' HA ' ' H ' ' A' ' 58' ' ' ALA . 19.9 t-20 -89.4 9.22 27.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 1.88 110.716 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.8 m -131.41 -32.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 2.69 111.114 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.431 ' HB2' ' NE2' ' A' ' 56' ' ' GLN . 46.4 mt-10 -92.23 -29.28 16.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 3.68 111.107 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.535 HE21 ' N ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER -134.11 -2.02 2.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.313 -0.403 . . . . 4.31 111.016 179.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 83.6 mtp 56.08 67.46 1.0 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.154 -0.476 . . . . 4.12 110.822 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.579 ' H ' ' HA ' ' A' ' 53' ' ' ASN . . . -72.83 -88.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 1.92 111.192 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.5 t -179.88 138.66 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.945 0.402 . . . . 2.47 111.452 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -66.44 -21.58 66.2 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.406 -0.59 . . . . 1.87 109.406 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.7 t -76.65 -11.59 59.88 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.397 -0.82 . . . . 2.05 110.752 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -48.61 13.51 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.814 -0.439 . . . . 1.12 109.814 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.495 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -69.87 -36.29 68.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.136 -0.69 . . . . 1.13 109.136 178.465 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.579 HD21 ' HB3' ' A' ' 104' ' ' LEU . 2.4 tm? -61.89 -57.8 10.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.91 -1.041 . . . . 1.13 110.72 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.34 -42.67 99.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.895 -0.593 . . . . 2.32 111.837 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.54 -32.06 72.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 1.01 110.968 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.432 ' HA2' ' CD2' ' A' ' 46' ' ' LEU . . . -78.49 -29.68 51.91 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.178 -1.011 . . . . 0.56 112.117 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.458 ' HZ1' ' HB3' ' A' ' 101' ' ' LEU . 0.7 OUTLIER -64.66 -46.31 83.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 107.997 -1.112 . . . . 1.57 107.997 177.004 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -59.85 -42.12 92.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.475 -1.239 . . . . 0.53 110.015 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.492 HD23 ' HB2' ' A' ' 42' ' ' SER . 2.4 tm? -62.57 -49.12 76.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.335 -0.848 . . . . 2.06 110.686 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.541 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . 1.4 t80 -59.02 -36.13 74.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.724 -0.671 . . . . 1.31 109.938 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 9.0 p -74.19 -24.81 59.41 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.877 -0.601 . . . . 1.45 112.559 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.418 ' O ' ' HB3' ' A' ' 77' ' ' TYR . 17.8 m-85 -78.78 -44.4 23.32 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 119.544 -0.862 . . . . 0.46 109.377 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.541 ' SG ' ' HA ' ' A' ' 71' ' ' TYR . 13.0 p -66.99 -21.72 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.37 -0.832 . . . . 1.54 109.534 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.402 HG12 ' N ' ' A' ' 76' ' ' SER . 0.6 OUTLIER -72.45 -43.93 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.588 -0.733 . . . . 1.13 110.09 179.001 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.402 ' N ' HG12 ' A' ' 75' ' ' VAL . 53.9 m -85.51 -2.5 58.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 1.51 110.253 178.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.418 ' HB3' ' O ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -99.26 -30.24 12.36 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.64 -0.709 . . . . 0.8 111.806 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.4 m -63.63 -2.86 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.121 0.415 . . . . 1.54 112.121 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -77.6 8.04 4.86 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.27 -0.423 . . . . 1.31 110.474 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.3 p -119.55 -10.45 9.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.032 -0.531 . . . . 1.93 110.884 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 78' ' ' VAL . 35.6 mm -50.31 131.37 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 116.354 -0.385 . . . . 1.39 110.897 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.661 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.3 OUTLIER -111.8 -31.19 7.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 116.407 -0.36 . . . . 2.55 111.692 -178.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.551 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 0.3 OUTLIER -43.99 -43.03 6.38 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.175 0.805 . . . . 3.3 113.175 -179.144 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.661 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 23.7 mmt 80.73 -92.89 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.701 0.63 . . . . 3.25 112.701 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -57.82 -9.88 1.46 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.003 0.43 . . . . 3.42 111.077 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.551 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -107.95 -19.3 13.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.763 -0.653 . . . . 2.49 110.18 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.585 ' HD2' ' HA ' ' A' ' 84' ' ' MET . 0.0 OUTLIER -52.32 -38.74 59.36 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.324 0.583 . . . . 2.88 109.463 179.036 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.572 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 84.2 m-85 -57.41 -42.83 83.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.796 -1.093 . . . . 3.08 109.992 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.01 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 1.17 111.224 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.592 ' O ' HG13 ' A' ' 94' ' ' ILE . 78.3 t80 -70.32 -45.59 65.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.31 -0.404 . . . . 0.39 111.917 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 9.4 ttp180 -56.73 -63.42 1.21 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.385 -0.37 . . . . 3.9 111.482 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -54.15 -34.8 61.28 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.325 -0.62 . . . . 2.58 109.325 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 90' ' ' PHE . . . -57.45 -40.15 77.83 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.884 -0.784 . . . . 0.96 108.884 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 90' ' ' PHE . 61.0 mt -60.48 -38.79 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 CA-C-N 115.139 -0.937 . . . . 1.09 109.085 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.622 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -63.4 -34.31 77.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.487 -1.233 . . . . 0.33 109.725 179.86 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.622 ' HD2' HD21 ' A' ' 95' ' ' ASN . 12.1 mptt -59.21 -45.26 91.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.657 -0.497 . . . . 2.3 109.657 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.563 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 28.7 tp -64.52 -31.77 73.12 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 116.339 -0.392 . . . . 1.29 110.305 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.1 -51.2 70.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.217 -0.447 . . . . 1.87 110.191 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 40.2 m-80 -72.65 -37.87 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.023 -0.535 . . . . 2.12 111.016 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.523 HD21 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -50.27 -45.54 54.44 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.499 -0.556 . . . . 0.42 109.499 178.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 7.5 mt -66.82 -38.86 87.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.364 -0.835 . . . . 1.23 109.14 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.574 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 48.6 mtt-85 -57.6 -35.12 70.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.427 -0.806 . . . . 2.63 111.214 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -88.02 -18.47 28.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.169 0.509 . . . . 2.32 109.845 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.579 ' HB3' HD21 ' A' ' 64' ' ' LEU . 14.9 tp -81.1 -34.67 32.46 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 114.092 1.145 . . . . 1.08 114.092 -178.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.574 ' NE2' ' O ' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -73.73 165.44 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.103 -0.639 . . . . 2.04 110.457 -177.578 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.676 HG23 ' H ' ' A' ' 107' ' ' CYS . 1.5 tp -36.46 -75.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 112.64 0.608 . . . . 2.22 112.64 -178.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.676 ' H ' HG23 ' A' ' 106' ' ' ILE . 0.0 OUTLIER 63.38 151.12 0.11 Allowed Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 110.48 -0.193 . . . . 2.44 110.48 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.452 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 69.5 Cg_exo -49.91 -77.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.356 2.038 . . . . 3.01 112.714 -179.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 178.59 22.06 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 4.42 111.013 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.0 m -44.31 -37.66 3.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.882 -0.599 . . . . 5.66 111.498 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -91.53 -34.03 14.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 5.83 111.431 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 133.62 70.8 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.936 -0.649 . . . . 5.65 112.239 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.4 m -80.36 101.47 8.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.771 0.32 . . . . 4.62 111.585 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -161.99 162.13 33.91 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.1 -0.571 . . . . 4.88 112.109 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.91 61.16 4.66 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.876 2.384 . . . . 6.39 112.065 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -174.2 18.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 4.3 110.856 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -108.34 135.81 49.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.409 . . . . 3.13 111.5 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.1 p -91.87 86.7 5.98 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-O 122.357 1.075 . . . . 2.58 109.778 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.91 84.18 2.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.173 -1.831 . . . . 2.53 111.425 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -96.79 144.25 26.94 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.731 -1.211 . . . . 2.16 107.731 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.463 ' CD2' HD12 ' A' ' 104' ' ' LEU . 2.7 m-30 -107.34 41.87 1.42 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.673 -0.411 . . . . 0.61 111.644 -177.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 93.6 p -83.08 -25.57 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.709 -0.478 . . . . 1.78 109.709 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -67.17 -31.07 71.23 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.32 -0.993 . . . . 3.05 108.32 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.469 ' O ' HD11 ' A' ' 124' ' ' LEU . 2.2 tp -70.11 -22.95 62.97 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.155 -0.929 . . . . 1.13 108.55 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.82 -49.67 19.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.066 -0.97 . . . . 1.99 110.069 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 m -67.12 -30.1 70.02 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.93 -0.577 . . . . 1.87 110.486 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.5 m -65.56 -44.76 85.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.831 -0.622 . . . . 1.66 111.11 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.43 HG12 ' HB ' ' A' ' 43' ' ' THR . 41.7 t -61.64 -53.8 43.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 1.29 111.32 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -51.87 -39.14 58.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.208 -0.451 . . . . 3.15 111.118 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.03 -50.8 71.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 2.1 112.311 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -55.48 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.78 0.324 . . . . 1.11 111.053 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.1 t -53.48 -45.56 69.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 1.44 111.131 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.71 -34.0 50.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.004 0.372 . . . . 0.37 112.004 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.6 mt -74.42 -51.23 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.661 0.615 . . . . 1.08 112.661 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.655 ' O ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -56.79 -35.51 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 112.517 0.562 . . . . 1.01 112.517 -178.752 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . 0.567 ' C ' ' HE ' ' A' ' 137' ' ' ARG . 41.1 mt-30 -67.99 -40.61 83.05 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.701 -0.4 . . . . 0.91 110.307 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.645 ' HA ' ' HE ' ' A' ' 137' ' ' ARG . 0.1 OUTLIER -90.54 48.33 1.53 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 122.054 0.931 . . . . 4.93 110.096 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.655 ' HB2' ' O ' ' A' ' 135' ' ' VAL . 1.1 tt -98.04 -91.48 0.26 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 113.787 -1.551 . . . . 2.5 111.541 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' H ' ' HB3' ' A' ' 138' ' ' LEU . 6.0 pt-20 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.423 -0.798 . . . . 4.17 111.161 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.694 0.283 . . . . 4.63 111.0 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.28 -33.2 83.54 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.638 -0.792 . . . . 2.94 112.059 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.05 16.85 2.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.435 . . . . 2.71 110.328 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.5 mm -143.69 90.27 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 CA-C-N 115.651 -0.704 . . . . 1.08 110.726 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.5 p -129.22 -175.27 3.51 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.734 . . . . 1.13 109.347 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HB2' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -63.41 -30.99 72.02 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.203 -0.666 . . . . 1.55 109.203 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.438 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.52 -47.81 79.98 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.134 -0.787 . . . . 0.18 111.134 178.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 52.2 t -63.91 -40.3 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 CA-C-O 121.682 0.753 . . . . 1.93 109.25 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.4 HG12 ' SG ' ' A' ' 74' ' ' CYS . 0.9 OUTLIER -63.04 -39.84 86.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.339 -1.3 . . . . 1.05 110.8 179.543 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.41 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 20.5 mt -65.81 -49.24 68.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.434 -0.348 . . . . 1.08 110.422 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -54.38 -33.51 59.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.59 -0.522 . . . . 0.24 109.59 178.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m -70.97 -41.72 70.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.561 -0.745 . . . . 0.96 110.789 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.583 HG22 HD12 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -63.75 -33.2 75.13 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.948 0.404 . . . . 1.08 110.703 179.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -72.74 -55.05 7.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 1.52 111.367 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.11 -47.51 23.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 1.07 111.296 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.65 HD23 HD23 ' A' ' 70' ' ' LEU . 4.1 pp -71.08 -38.88 72.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 1.04 110.08 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 34.6 t -53.89 -52.27 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 1.15 110.416 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mp -60.2 -35.03 74.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.033 -0.53 . . . . 1.95 110.003 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.414 ' HB2' ' HB3' ' A' ' 62' ' ' ALA . . . -60.23 -35.58 75.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 1.03 109.75 178.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.539 HG12 ' HB ' ' A' ' 63' ' ' VAL . 3.0 mt -69.56 -40.2 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 N-CA-C 109.027 -0.731 . . . . 1.02 109.027 178.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.9 t -75.02 -9.38 58.48 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.022 -0.99 . . . . 1.01 109.98 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.544 ' HG2' ' HB2' ' A' ' 58' ' ' ALA . 75.7 ttt180 -79.77 -40.85 27.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.543 -0.753 . . . . 3.48 110.793 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.65 ' HB2' ' HB3' ' A' ' 59' ' ' SER . 24.6 t-20 -65.54 13.33 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.557 -0.292 . . . . 1.88 111.657 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' ' 52' ' ' ARG . 47.2 t -100.87 -19.37 15.96 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.085 0.469 . . . . 2.69 110.684 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.509 ' O ' ' HB3' ' A' ' 56' ' ' GLN . 23.4 tt0 -109.97 -0.78 18.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.636 -0.711 . . . . 3.68 109.823 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.509 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 0.4 OUTLIER 164.0 136.32 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.046 -0.979 . . . . 4.31 108.96 -179.251 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.518 ' HA ' ' ND2' ' A' ' 53' ' ' ASN . 66.0 mtm -41.89 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.617 0.246 . . . . 4.12 110.667 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.544 ' HB2' ' HG2' ' A' ' 52' ' ' ARG . . . -160.4 71.76 0.46 Allowed 'General case' 0 C--O 1.231 0.129 0 N-CA-C 113.053 0.76 . . . . 1.92 113.053 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.651 ' HB2' HG12 ' A' ' 63' ' ' VAL . 51.4 p -165.22 -46.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.348 0.499 . . . . 2.47 112.348 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.429 ' HE2' ' N ' ' A' ' 106' ' ' ILE . 35.3 t-80 -48.74 -27.51 2.98 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.237 -0.585 . . . . 1.87 110.866 -177.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.2 p -97.12 -33.79 11.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.978 0.418 . . . . 2.05 110.713 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.414 ' HB3' ' HB2' ' A' ' 49' ' ' ALA . . . -81.49 -55.06 4.93 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.491 0.923 . . . . 1.12 113.491 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.651 HG12 ' HB2' ' A' ' 59' ' ' SER . 0.4 OUTLIER -64.85 -32.23 57.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 120.716 -0.394 . . . . 1.13 110.834 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.76 -58.4 3.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.453 -0.339 . . . . 1.13 111.192 178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -58.59 -44.67 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.385 0.612 . . . . 2.32 110.343 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.89 -26.51 63.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.343 -0.984 . . . . 1.01 108.343 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.89 -46.64 91.08 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 114.835 -1.075 . . . . 0.56 112.488 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' HD2' HD11 ' A' ' 101' ' ' LEU . 1.3 mptm? -64.99 -42.91 94.1 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.881 0.372 . . . . 1.57 110.826 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -58.09 -39.04 77.59 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.924 -0.58 . . . . 0.53 110.777 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.65 HD23 HD23 ' A' ' 46' ' ' LEU . 10.6 tp -66.63 -50.58 62.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 2.06 111.337 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 98' ' ' GLU . 15.1 t80 -54.76 -35.75 64.11 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.083 -0.71 . . . . 1.31 109.083 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 t -67.14 -41.96 85.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.999 -1.0 . . . . 1.45 111.848 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.4 -43.31 81.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 119.918 -0.713 . . . . 0.46 110.47 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.409 ' O ' HG21 ' A' ' 78' ' ' VAL . 1.1 m -62.79 -22.89 66.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.866 -0.606 . . . . 1.54 109.972 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 1.2 t -75.17 -45.72 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.576 -0.738 . . . . 1.13 111.03 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.1 m -83.87 -3.32 57.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 1.51 110.665 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -96.38 -32.21 12.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.811 -0.631 . . . . 0.8 111.326 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.4 m -67.86 -6.06 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.048 0.451 . . . . 1.54 111.674 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -79.6 8.46 6.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.119 -0.491 . . . . 1.31 110.084 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 t -127.64 -5.16 5.84 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.853 -0.612 . . . . 1.93 111.054 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.649 HG13 ' HG3' ' A' ' 87' ' ' LYS . 28.9 mm -31.75 -66.02 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.079 0 N-CA-C 112.417 0.525 . . . . 1.39 112.417 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.592 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 77.49 -43.88 0.42 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.263 0.838 . . . . 2.55 113.263 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.711 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 1.5 mt-30 -50.33 -26.39 4.8 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.039 0.755 . . . . 3.3 113.039 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.53 ' C ' ' H ' ' A' ' 86' ' ' ASN . 27.6 mtm 74.47 -86.87 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.973 1.101 . . . . 3.25 113.973 177.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -64.75 6.36 0.23 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.963 0.411 . . . . 3.42 111.722 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.711 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -119.39 -12.51 9.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.528 0.68 . . . . 2.49 109.407 -179.794 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.649 ' HG3' HG13 ' A' ' 81' ' ' ILE . 2.2 ttpp -57.8 -47.45 82.54 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.752 -1.113 . . . . 2.88 110.751 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -55.82 -46.17 78.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.484 -0.78 . . . . 3.08 110.75 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 92' ' ' GLU . . . -47.55 -70.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.412 0.523 . . . . 1.17 112.412 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.571 ' O ' HG13 ' A' ' 94' ' ' ILE . 63.7 t80 -62.47 -43.62 98.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.364 0.505 . . . . 0.39 112.364 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 8.2 ttp180 -56.02 -62.14 1.91 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.617 -0.265 . . . . 3.9 111.423 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -52.96 -33.1 49.51 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.522 -0.308 . . . . 2.58 110.549 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.94 85.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.478 0.656 . . . . 0.96 109.703 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 90' ' ' PHE . 6.3 mt -64.25 -34.31 68.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.351 -0.84 . . . . 1.09 109.471 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.598 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -63.41 -36.09 82.59 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.882 -1.054 . . . . 0.33 109.308 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.598 ' HD2' HD21 ' A' ' 95' ' ' ASN . 0.8 OUTLIER -59.65 -47.63 84.87 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.213 -0.662 . . . . 2.3 109.213 178.555 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.626 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.74 -39.75 85.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.512 -0.767 . . . . 1.29 109.832 178.452 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.453 ' HB2' ' CD1' ' A' ' 71' ' ' TYR . 8.6 tp10 -57.38 -58.01 10.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.466 -0.788 . . . . 1.87 111.029 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.522 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 52.9 m-80 -61.79 -31.68 71.91 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.717 -0.475 . . . . 2.12 109.717 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.589 HD21 HD22 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -63.14 -38.47 91.32 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.699 -0.852 . . . . 0.42 108.699 178.261 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 8.9 mt -67.39 -41.7 84.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.159 -1.052 . . . . 1.23 108.159 177.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.619 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 71.3 mtp180 -56.27 -38.59 71.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.242 -1.344 . . . . 2.63 111.549 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -89.45 -17.77 28.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.035 -0.529 . . . . 2.32 111.743 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.431 HD13 ' CD2' ' A' ' 121' ' ' PHE . 16.5 tp -86.13 -25.31 25.83 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.935 1.087 . . . . 1.08 113.935 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.732 HE21 ' H ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -68.63 162.54 25.72 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.554 -0.458 . . . . 2.04 110.451 -178.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.642 HG21 ' H ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -26.72 -63.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 113.541 0.941 . . . . 2.22 113.541 -178.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.642 ' H ' HG21 ' A' ' 106' ' ' ILE . 7.5 t 60.02 144.24 0.05 OUTLIER Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 120.81 0.338 . . . . 2.44 111.51 -179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.471 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 42.6 Cg_exo -55.07 -73.99 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.51 2.14 . . . . 3.01 112.564 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -171.63 22.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 4.42 110.731 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -45.71 -34.33 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.53 -0.759 . . . . 5.66 111.869 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.98 131.78 10.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.875 0.369 . . . . 5.83 111.705 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 56.1 26.21 48.77 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.912 -0.586 . . . . 5.65 112.941 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 m 51.48 -99.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 4.62 111.295 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -150.77 -112.16 0.56 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.817 -0.706 . . . . 4.88 112.53 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.75 -169.78 0.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.217 1.944 . . . . 6.39 112.373 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 58.87 61.84 2.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.165 -0.47 . . . . 4.3 111.544 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -167.69 -75.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.435 -0.348 . . . . 3.13 111.397 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.0 t 173.11 119.01 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.91 -0.586 . . . . 2.58 110.814 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 17.9 mm-40 -108.3 82.17 1.59 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.816 -0.629 . . . . 2.53 110.577 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -106.77 92.26 4.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.307 -0.86 . . . . 2.16 109.948 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.462 ' HB2' HG21 ' A' ' 50' ' ' ILE . 1.4 m-30 -94.36 42.56 1.09 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.507 . . . . 0.61 111.448 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.4 m -67.06 -21.54 65.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 1.78 110.363 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.427 ' N ' ' HD3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -65.67 -42.14 91.67 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.348 -0.612 . . . . 3.05 109.348 178.864 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.512 HD21 HD22 ' A' ' 100' ' ' ASN . 2.4 tp -60.79 -26.51 67.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.858 -0.793 . . . . 1.13 108.858 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 tp -70.25 -49.07 53.71 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.232 -0.895 . . . . 1.99 109.933 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -63.19 -36.15 82.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.886 -0.597 . . . . 1.87 110.482 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 131' ' ' ILE . 74.0 m -59.72 -42.56 93.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.833 -0.622 . . . . 1.66 110.729 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.448 HG13 HG21 ' A' ' 43' ' ' THR . 41.8 t -60.32 -53.11 53.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.053 -0.521 . . . . 1.29 111.019 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -50.67 -43.32 57.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 3.15 111.33 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.81 -56.35 22.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 2.1 112.209 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 127' ' ' SER . 0.1 OUTLIER -50.34 -55.7 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 121.018 -0.273 . . . . 1.11 111.179 -178.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 56.7 p -55.25 -46.26 76.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.94 0.4 . . . . 1.44 110.405 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.547 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 23.6 t70 -53.51 -21.82 7.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.089 -0.505 . . . . 0.37 111.89 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 70.1 mt -88.34 -48.39 14.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.643 0.609 . . . . 1.08 112.643 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.593 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . 0.4 OUTLIER -59.91 -50.34 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 114.371 1.248 . . . . 1.01 114.371 -177.693 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . 0.693 ' HB2' ' NH2' ' A' ' 137' ' ' ARG . 44.3 mt-30 -44.37 -56.21 4.39 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.134 0.42 . . . . 0.91 112.134 -177.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.693 ' NH2' ' HB2' ' A' ' 136' ' ' GLN . 0.0 OUTLIER -70.19 -37.45 75.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.273 0.559 . . . . 4.93 109.518 178.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.593 ' HB3' ' HA ' ' A' ' 135' ' ' VAL . 4.9 tp -52.98 -76.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.984 -1.007 . . . . 2.5 110.89 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.543 ' HG3' ' HG ' ' A' ' 138' ' ' LEU . 42.6 mt-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.271 -0.871 . . . . 4.17 110.824 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.689 0.281 . . . . 4.63 110.93 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 53.13 35.53 49.63 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.817 -0.706 . . . . 2.94 112.262 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 43.51 34.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.173 0.435 . . . . 2.71 112.173 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.643 ' HA ' HG13 ' A' ' 38' ' ' VAL . 40.5 mm 64.41 109.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.947 -0.57 . . . . 1.08 112.023 179.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.469 ' O ' HG11 ' A' ' 38' ' ' VAL . 81.9 p -126.57 -159.57 0.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.441 -0.799 . . . . 1.13 109.614 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.498 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -74.45 -27.76 60.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.718 -0.475 . . . . 1.55 109.718 178.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.55 -47.96 82.26 Favored Glycine 0 N--CA 1.453 -0.188 0 CA-C-N 115.642 -0.708 . . . . 0.18 112.021 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.643 HG13 ' HA ' ' A' ' 34' ' ' ILE . 12.4 p -66.68 -37.69 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.518 0.675 . . . . 1.93 109.366 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.454 ' N ' HG12 ' A' ' 38' ' ' VAL . 1.1 t -63.51 -41.48 92.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.622 -1.172 . . . . 1.05 110.962 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.419 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 31.4 mt -65.23 -51.29 61.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.789 0.328 . . . . 1.08 110.285 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.28 -31.41 32.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.152 0.501 . . . . 0.24 109.765 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.3 m -73.14 -42.41 62.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.415 -0.811 . . . . 0.96 111.093 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.544 HG23 HD12 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -63.01 -35.47 80.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.338 . . . . 1.08 111.184 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -72.95 -53.8 10.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 1.52 111.508 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.58 -47.86 28.35 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.348 -0.387 . . . . 1.07 111.69 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.581 HD22 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -70.67 -39.63 73.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.483 -0.326 . . . . 1.04 110.172 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 47.2 t -55.25 -37.98 67.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 1.15 109.93 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.67 -36.25 78.28 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.661 -0.7 . . . . 1.95 109.717 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.74 77.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.605 -0.517 . . . . 1.03 109.605 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.507 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -71.96 -27.37 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 N-CA-C 108.779 -0.823 . . . . 1.02 108.779 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -83.72 -14.82 50.73 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.18 -0.918 . . . . 1.01 109.696 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.405 ' HA ' HE22 ' A' ' 56' ' ' GLN . 42.7 mtp180 -90.78 -18.36 25.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.588 -0.733 . . . . 3.48 111.323 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -83.62 9.59 11.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 1.88 110.504 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.2 p -130.28 -25.06 2.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 2.69 110.884 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -100.58 -18.85 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 3.68 111.129 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.455 HE21 ' N ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER -144.95 3.34 1.06 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.362 -0.381 . . . . 4.31 111.676 -179.82 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 60.7 mtt 52.2 48.45 22.65 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.489 -0.323 . . . . 4.12 110.758 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.33 -89.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 1.92 111.716 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.9 p -176.24 143.58 0.53 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 2.47 111.06 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -72.13 -19.82 61.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.512 . . . . 1.87 109.989 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -78.34 -9.02 59.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.662 -0.699 . . . . 2.05 110.539 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.67 -45.81 23.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 1.12 110.403 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.507 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -76.19 -27.9 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.718 -0.673 . . . . 1.13 109.974 179.006 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.602 HD21 ' NE2' ' A' ' 105' ' ' GLN . 2.1 tm? -73.9 -52.45 12.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.35 -0.841 . . . . 1.13 110.793 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -60.23 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.484 0.659 . . . . 2.32 109.463 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.99 -27.9 67.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.064 -0.971 . . . . 1.01 108.419 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.78 -47.31 87.48 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.874 -1.057 . . . . 0.56 112.154 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -38.14 86.14 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.057 0.456 . . . . 1.57 110.098 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.454 ' N ' HD21 ' A' ' 69' ' ' ASN . 0.9 OUTLIER -60.22 -46.03 91.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.658 -0.701 . . . . 0.53 110.5 179.685 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.581 HD22 HD22 ' A' ' 46' ' ' LEU . 14.4 tp -57.99 -48.41 80.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.766 -0.652 . . . . 2.06 110.689 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.473 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 23.8 t80 -59.22 -34.98 72.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.201 -0.454 . . . . 1.31 110.059 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 t -76.46 -19.33 58.14 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.85 -0.614 . . . . 1.45 112.009 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -84.71 -44.64 13.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.789 -0.819 . . . . 0.46 108.789 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.465 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 4.3 m -69.44 -20.33 63.77 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.643 -0.708 . . . . 1.54 109.09 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.473 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.8 OUTLIER -72.96 -45.37 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-N 115.617 -0.719 . . . . 1.13 110.364 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.7 t -81.17 -11.06 59.52 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 121.064 0.459 . . . . 1.51 110.357 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.434 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -93.57 -29.19 15.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.668 -0.696 . . . . 0.8 110.407 179.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.516 ' O ' HG12 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -62.1 -30.05 47.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.846 -0.615 . . . . 1.54 111.858 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.87 -4.45 20.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.067 0.461 . . . . 1.31 110.297 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -104.87 7.07 34.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.688 -0.687 . . . . 1.93 111.444 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.586 ' HB ' ' HD2' ' A' ' 87' ' ' LYS . 5.5 mm -70.11 95.92 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.868 0.366 . . . . 1.39 110.952 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.609 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.0 OUTLIER -80.91 -26.04 37.08 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.76 -0.83 . . . . 2.55 108.76 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.818 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 5.7 mm100 -37.63 -41.65 0.49 Allowed 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.201 -1.363 . . . . 3.3 113.9 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.609 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 19.1 mmt 82.09 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.856 1.058 . . . . 3.25 113.856 178.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -71.74 29.92 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.976 0.417 . . . . 3.42 111.3 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.818 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -138.8 -23.94 0.93 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.891 -0.595 . . . . 2.49 110.795 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.588 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 5.4 mtmt -39.13 -54.52 1.74 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.859 -0.61 . . . . 2.88 111.045 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.413 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 88.5 m-85 -55.34 -48.94 73.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.534 -0.757 . . . . 3.08 111.453 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.41 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -47.03 -69.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.909 0.337 . . . . 1.17 111.909 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.574 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 t80 -60.05 -44.55 94.61 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.184 0.438 . . . . 0.39 112.184 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.588 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -55.1 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.585 0.231 . . . . 3.9 111.387 -178.337 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 12.1 pt-20 -50.82 -36.74 38.88 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.333 -0.394 . . . . 2.58 110.235 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.11 -39.63 82.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.125 0.488 . . . . 0.96 109.822 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.574 HG13 ' O ' ' A' ' 90' ' ' PHE . 9.1 mt -62.97 -38.97 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 CA-C-N 115.62 -0.718 . . . . 1.09 109.396 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.527 ' ND2' ' N ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -57.57 -43.62 84.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.834 -1.075 . . . . 0.33 110.045 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.527 ' N ' ' ND2' ' A' ' 95' ' ' ASN . 0.1 OUTLIER -56.42 -50.36 71.86 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.336 -0.393 . . . . 2.3 110.264 179.159 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.616 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -54.93 -41.62 71.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.816 -0.629 . . . . 1.29 109.804 178.76 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.466 ' HB3' ' O ' ' A' ' 95' ' ' ASN . 7.8 tp10 -57.1 -59.97 4.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.443 -0.799 . . . . 1.87 110.881 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -66.72 -9.33 35.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 2.12 110.227 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.642 HD21 HD23 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -85.13 -37.73 19.89 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.516 -1.29 . . . . 0.42 107.516 178.773 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.642 HD23 HD21 ' A' ' 100' ' ' ASN . 7.6 mt -67.75 -39.88 84.16 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.416 -1.327 . . . . 1.23 107.416 177.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.583 ' O ' ' HB2' ' A' ' 105' ' ' GLN . 75.1 mtt180 -55.9 -53.52 55.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.293 -1.321 . . . . 2.63 110.686 178.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -68.93 -23.89 64.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.709 -0.478 . . . . 2.32 109.709 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 38.6 tp -76.13 -17.54 59.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.621 -0.718 . . . . 1.08 110.339 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.602 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -50.98 166.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.68 -0.691 . . . . 2.04 110.398 179.252 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.445 HG21 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -43.14 -49.99 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.589 -0.278 . . . . 2.22 111.285 -179.54 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.453 ' SG ' ' HD2' ' A' ' 108' ' ' PRO . 33.8 t 62.23 137.39 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-O 121.617 0.722 . . . . 2.44 112.222 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.453 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 43.2 Cg_endo -76.68 -80.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 123.671 2.914 . . . . 3.01 112.806 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.444 ' H ' ' HG2' ' A' ' 108' ' ' PRO . . . -177.66 14.71 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.815 -1.084 . . . . 4.42 108.944 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.44 ' C ' ' O ' ' A' ' 109' ' ' ALA . 18.0 m 21.92 77.58 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.329 -1.305 . . . . 5.66 112.146 -177.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 61.06 103.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.934 -1.03 . . . . 5.83 111.734 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 62.53 -130.28 43.24 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.922 -0.656 . . . . 5.65 112.863 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.6 t -167.97 -169.64 1.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.687 0.279 . . . . 4.62 110.495 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -158.12 -95.17 0.11 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.823 -0.703 . . . . 4.88 111.639 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.414 ' O ' ' HB3' ' A' ' 116' ' ' ALA . 25.8 Cg_exo -61.95 -67.99 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 121.815 1.677 . . . . 6.39 110.953 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 115' ' ' PRO . . . 170.12 -70.78 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.63 -0.714 . . . . 4.3 110.696 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -145.46 -59.66 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 3.13 110.783 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.7 p 55.92 110.97 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.367 0.603 . . . . 2.58 111.573 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -124.22 82.77 2.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.442 -0.799 . . . . 2.53 111.071 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -139.08 81.63 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.452 -0.794 . . . . 2.16 108.916 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.483 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.7 OUTLIER -79.48 53.13 1.49 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.497 -0.774 . . . . 0.61 112.176 -177.902 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 88.6 p -75.68 -16.7 60.14 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.737 -0.468 . . . . 1.78 109.737 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.442 ' HE2' ' HB2' ' A' ' 123' ' ' LYS . 3.4 mppt? -69.9 -41.91 74.08 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.049 -0.722 . . . . 3.05 109.049 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.601 HD22 HD22 ' A' ' 100' ' ' ASN . 1.3 tp -61.63 -25.31 67.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.575 -0.898 . . . . 1.13 108.575 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.29 -48.7 49.1 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.007 -0.997 . . . . 1.99 109.925 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 50.7 m -63.43 -35.75 81.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.754 -0.657 . . . . 1.87 110.51 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 131' ' ' ILE . 39.9 t -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 1.66 110.74 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.441 HG11 HG22 ' A' ' 43' ' ' THR . 17.9 t -60.87 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 1.29 111.124 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -54.57 -38.28 66.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.577 -0.738 . . . . 3.15 112.073 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -60.86 -56.17 24.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.474 0.546 . . . . 2.1 112.474 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.497 ' H ' HG13 ' A' ' 131' ' ' ILE . 1.3 mt -52.68 -54.15 17.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 121.078 0.466 . . . . 1.11 110.811 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.5 t -53.45 -47.91 69.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.762 -0.653 . . . . 1.44 111.18 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.16 -25.81 61.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.37 111.626 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.478 ' HA ' ' NE ' ' A' ' 137' ' ' ARG . 78.1 mt -73.33 -51.88 23.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.039 0.385 . . . . 1.08 112.039 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.498 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -62.19 -35.94 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.309 0.485 . . . . 1.01 112.309 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.34 -60.34 3.07 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.981 -0.288 . . . . 0.91 111.231 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.478 ' NE ' ' HA ' ' A' ' 134' ' ' ILE . 0.0 OUTLIER -67.84 -12.37 60.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.179 0.514 . . . . 4.93 110.114 179.402 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.458 HD11 HG21 ' A' ' 134' ' ' ILE . 5.2 tp -52.14 -81.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.535 -0.757 . . . . 2.5 111.122 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.45 ' H ' ' HB3' ' A' ' 138' ' ' LEU . 8.6 pt-20 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.65 -0.69 . . . . 4.17 111.169 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 95.9 p . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 120.662 0.268 . . . . 4.63 111.408 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.49 -41.21 98.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.235 -0.983 . . . . 2.94 111.258 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.01 12.72 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 2.71 109.718 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.626 ' HA ' HG11 ' A' ' 38' ' ' VAL . 37.1 mm -141.92 90.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.411 -0.813 . . . . 1.08 111.091 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.496 ' O ' HG12 ' A' ' 38' ' ' VAL . 73.9 p -125.65 -158.98 0.87 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.766 -0.828 . . . . 1.13 108.766 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.523 ' HB2' HG22 ' A' ' 135' ' ' VAL . 6.1 ttpt -66.5 -35.93 81.48 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.91 -0.716 . . . . 1.55 109.141 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.21 -49.37 63.78 Favored Glycine 0 N--CA 1.452 -0.237 0 CA-C-N 114.989 -1.005 . . . . 0.18 113.005 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.626 HG11 ' HA ' ' A' ' 34' ' ' ILE . 9.7 p -65.26 -37.81 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.205 0 CA-C-O 121.467 0.651 . . . . 1.93 109.866 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.559 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.0 OUTLIER -65.03 -36.31 77.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 114.671 -1.15 . . . . 1.05 111.08 -179.753 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.462 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 26.8 mt -71.13 -51.54 24.41 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.916 -0.314 . . . . 1.08 110.548 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -54.04 -34.18 59.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.24 109.801 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.472 ' C ' HD21 ' A' ' 70' ' ' LEU . 65.9 m -73.62 -44.16 57.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.401 -0.818 . . . . 0.96 111.179 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.601 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.8 OUTLIER -64.25 -31.44 72.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.986 0.422 . . . . 1.08 110.566 178.622 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -72.46 -54.94 7.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.826 -0.625 . . . . 1.52 111.06 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.79 -47.33 20.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.115 -0.493 . . . . 1.07 111.382 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.1 pp -72.11 -38.83 69.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.827 -0.349 . . . . 1.04 110.355 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.41 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.4 t -55.35 -37.65 67.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 1.15 110.249 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.96 -38.82 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.923 -0.58 . . . . 1.95 110.0 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.38 -46.3 76.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.717 -0.475 . . . . 1.03 109.717 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.584 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -62.3 -39.74 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.817 -0.809 . . . . 1.02 108.817 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.0 t -61.43 -17.04 52.47 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.585 -0.895 . . . . 1.01 108.585 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.484 ' C ' ' H ' ' A' ' 54' ' ' SER . 42.3 mtt180 -106.38 -106.62 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.854 -1.066 . . . . 3.48 110.923 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.477 HD21 ' HB1' ' A' ' 58' ' ' ALA . 10.5 m120 41.35 18.86 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.036 0.446 . . . . 1.88 111.834 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.484 ' H ' ' C ' ' A' ' 52' ' ' ARG . 46.9 m -152.13 -16.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.771 -0.65 . . . . 2.69 109.895 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.545 ' HB2' HE22 ' A' ' 56' ' ' GLN . 11.7 mm-40 -61.94 -26.56 68.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.594 -0.73 . . . . 3.68 110.333 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.661 HE21 ' H ' ' A' ' 57' ' ' MET . 0.7 OUTLIER -172.86 -58.29 0.02 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.217 -0.447 . . . . 4.31 111.087 179.46 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.661 ' H ' HE21 ' A' ' 56' ' ' GLN . 59.0 mtt -146.04 -113.49 0.09 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.406 -0.361 . . . . 4.12 110.15 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.477 ' HB1' HD21 ' A' ' 53' ' ' ASN . . . 72.57 -47.75 0.67 Allowed 'General case' 0 CA--C 1.518 -0.283 0 O-C-N 123.339 0.4 . . . . 1.92 112.0 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' A' ' 58' ' ' ALA . 6.2 t 64.91 164.36 0.15 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.823 0.345 . . . . 2.47 111.664 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 -63.54 -18.06 63.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.466 -0.568 . . . . 1.87 109.466 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.8 m -70.88 -8.25 51.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.473 -0.785 . . . . 2.05 110.335 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 58' ' ' ALA . . . -79.59 -47.17 15.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.155 0.502 . . . . 1.12 109.996 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.584 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.98 -28.79 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.449 -0.796 . . . . 1.13 109.775 178.832 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.617 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.0 OUTLIER -73.86 -51.49 16.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.132 -0.94 . . . . 1.13 111.015 179.002 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.48 -50.72 70.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.242 0.544 . . . . 2.32 109.723 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.74 -26.91 67.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.375 -0.972 . . . . 1.01 108.375 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.427 ' HA2' HD23 ' A' ' 46' ' ' LEU . . . -64.14 -46.48 90.97 Favored Glycine 0 N--CA 1.442 -0.906 0 CA-C-N 114.865 -1.061 . . . . 0.56 112.324 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.451 ' HZ3' HE22 ' A' ' 105' ' ' GLN . 0.4 OUTLIER -63.18 -41.83 99.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.74 0.305 . . . . 1.57 110.687 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.462 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.7 m-80 -58.42 -40.46 82.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.53 110.995 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.601 HD21 ' N ' ' A' ' 43' ' ' THR . 2.6 tm? -65.35 -50.47 65.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 2.06 110.865 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.431 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 12.6 t80 -56.44 -29.86 62.15 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.375 -0.972 . . . . 1.31 108.375 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 32.8 t -67.73 -53.35 28.16 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.927 -1.033 . . . . 1.45 111.112 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.03 -43.62 95.18 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.306 -0.558 . . . . 0.46 111.715 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.475 ' HG ' HG22 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -59.63 -52.09 67.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.927 0.394 . . . . 1.54 110.904 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.45 -33.92 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 112.871 0.693 . . . . 1.13 112.871 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.5 t -90.92 -13.36 33.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.038 0.447 . . . . 1.51 110.794 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.455 ' HB2' HG21 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -88.24 -24.2 23.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.684 -0.689 . . . . 0.8 111.379 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.7 m -69.8 -12.89 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 1.54 111.374 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -68.59 -5.64 21.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 1.31 110.355 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.8 m -118.36 6.89 11.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.854 -0.612 . . . . 1.93 111.449 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.492 ' CG2' HD22 ' A' ' 86' ' ' ASN . 1.0 OUTLIER -47.68 -24.95 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.211 0.448 . . . . 1.39 112.211 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.552 ' C ' ' NE2' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 64.32 -70.38 0.08 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.144 0.497 . . . . 2.55 110.276 -177.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.625 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 2.3 mm100 -51.8 173.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.122 -0.945 . . . . 3.3 109.801 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.615 ' H ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -140.42 -20.22 0.85 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.46 -0.496 . . . . 3.25 111.418 -178.196 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -95.34 15.86 18.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.857 -0.794 . . . . 3.42 108.857 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.66 ' H ' HD21 ' A' ' 86' ' ' ASN . 0.1 OUTLIER -128.87 -30.88 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.863 -1.062 . . . . 2.49 110.863 -179.029 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 11.1 tttm -42.37 -52.23 4.64 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.878 -0.601 . . . . 2.88 111.916 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -55.04 -45.89 75.28 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.846 -0.341 . . . . 3.08 110.827 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -50.58 -71.0 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.914 0.387 . . . . 1.17 111.987 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 71.4 t80 -61.37 -46.02 91.92 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.476 0.547 . . . . 0.39 112.476 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.616 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -56.48 -57.96 10.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.536 0.207 . . . . 3.9 111.235 -178.084 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.7 pt-20 -50.3 -37.64 37.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.4 -0.364 . . . . 2.58 110.165 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.0 -41.66 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.38 0.61 . . . . 0.96 109.569 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' PHE . 17.8 mt -62.48 -42.97 97.78 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.433 -0.803 . . . . 1.09 109.328 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.574 HD21 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -55.7 -38.9 70.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.86 -1.064 . . . . 0.33 109.371 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.574 ' HD2' HD21 ' A' ' 95' ' ' ASN . 1.1 mptm? -57.17 -46.98 82.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.978 -0.556 . . . . 2.3 109.956 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.582 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 33.2 tp -58.96 -36.15 74.34 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 120.956 0.408 . . . . 1.29 110.147 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.7 OUTLIER -57.24 -59.08 5.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.871 -0.604 . . . . 1.87 110.169 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.414 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 34.1 m-80 -71.31 -10.06 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.853 -0.612 . . . . 2.12 111.032 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.478 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.47 -47.95 14.75 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 108.58 -0.896 . . . . 0.42 108.58 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 7.5 mt -64.44 -33.86 76.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.393 -0.966 . . . . 1.23 108.393 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 81.4 mtt180 -55.04 -55.68 28.3 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 114.944 -1.025 . . . . 2.63 110.899 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -73.1 -19.69 61.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.022 0.439 . . . . 2.32 110.47 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.528 HD22 HD23 ' A' ' 64' ' ' LEU . 51.6 tp -76.27 -16.94 59.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.769 -0.65 . . . . 1.08 111.286 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.617 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -52.03 167.45 0.12 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.374 -0.376 . . . . 2.04 111.232 -179.773 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.501 HG21 ' H ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -56.83 -56.48 14.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.21 -0.45 . . . . 2.22 111.429 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.501 ' H ' HG21 ' A' ' 106' ' ' ILE . 6.7 t 59.93 143.92 0.05 OUTLIER Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 120.946 0.403 . . . . 2.44 111.844 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.465 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 52.3 Cg_exo -53.14 -73.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.683 2.255 . . . . 3.01 112.879 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -148.94 -13.73 0.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 4.42 111.297 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.7 m -54.54 -27.56 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.254 -0.43 . . . . 5.66 111.182 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -50.42 73.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 5.83 111.188 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 166.66 74.28 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 5.65 112.659 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.2 t -96.77 110.88 23.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.674 0.273 . . . . 4.62 111.081 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -167.76 -94.67 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.56 -0.828 . . . . 4.88 112.755 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.16 -46.56 32.0 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.337 2.025 . . . . 6.39 112.296 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -166.71 -65.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 4.3 111.072 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -161.74 -40.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 3.13 111.3 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 73.0 p 51.61 106.42 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.295 0.569 . . . . 2.58 111.686 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -134.2 85.94 2.23 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.518 -0.765 . . . . 2.53 111.314 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -119.54 89.53 3.15 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.541 -1.208 . . . . 2.16 109.188 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.453 ' HB2' HG23 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -93.3 42.55 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.025 -0.534 . . . . 0.61 112.027 -178.109 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 80.2 p -69.75 -17.05 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.676 -0.41 . . . . 1.78 110.014 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -48.21 68.13 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.651 -0.87 . . . . 3.05 108.651 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.484 HD12 ' O ' ' A' ' 124' ' ' LEU . 1.5 tp -54.24 -25.76 24.98 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.214 -0.903 . . . . 1.13 109.251 177.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.78 -48.41 54.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.328 -0.851 . . . . 1.99 110.247 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.5 p -66.85 -35.04 79.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.126 -0.488 . . . . 1.87 111.116 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 26.0 t -62.77 -42.53 99.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 1.66 111.302 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.14 -50.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.113 -0.494 . . . . 1.29 110.852 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -53.19 -37.65 62.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.89 -0.595 . . . . 3.15 110.548 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.406 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.5 tt0 -60.46 -56.43 21.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.712 -0.677 . . . . 2.1 112.32 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.62 -55.74 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.95 0.405 . . . . 1.11 111.187 -178.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.414 ' OG ' ' NE2' ' A' ' 136' ' ' GLN . 7.5 t -54.13 -45.57 71.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.61 . . . . 1.44 111.353 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.45 -26.06 64.9 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.151 0.426 . . . . 0.37 112.151 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.495 ' O ' ' HB2' ' A' ' 138' ' ' LEU . 81.3 mt -75.5 -52.51 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 112.041 0.386 . . . . 1.08 112.041 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.523 HG22 ' HB2' ' A' ' 36' ' ' LYS . 1.4 p -59.67 -37.45 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 112.537 0.569 . . . . 1.01 112.537 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . 0.552 ' C ' ' HE ' ' A' ' 137' ' ' ARG . 66.9 mt-30 -70.06 -56.29 7.29 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.75 -0.38 . . . . 0.91 110.711 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.618 ' HA ' ' HE ' ' A' ' 137' ' ' ARG . 0.1 OUTLIER -87.02 51.62 2.3 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 122.267 1.032 . . . . 4.93 109.688 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.5 ' HB3' ' O ' ' A' ' 135' ' ' VAL . 1.9 tp -117.07 -78.73 0.58 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.382 -1.735 . . . . 2.5 110.762 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.57 -0.729 . . . . 4.17 111.776 179.864 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 38.5 p . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.704 0.288 . . . . 4.63 111.015 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 54.47 47.35 69.86 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.742 -0.742 . . . . 2.94 112.118 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 45.89 26.97 0.43 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.894 0.378 . . . . 2.71 111.914 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.636 ' HA ' HG13 ' A' ' 38' ' ' VAL . 44.2 mm 64.32 108.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.671 -0.695 . . . . 1.08 112.215 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.49 ' O ' HG11 ' A' ' 38' ' ' VAL . 81.9 p -123.08 -160.46 0.9 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.266 -0.879 . . . . 1.13 109.09 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.482 ' HG3' HG23 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.28 -30.52 60.46 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.177 -0.609 . . . . 1.55 109.408 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.83 -47.61 89.61 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.418 -0.81 . . . . 0.18 111.827 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.636 HG13 ' HA ' ' A' ' 34' ' ' ILE . 13.9 p -67.09 -37.97 80.32 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-O 121.455 0.645 . . . . 1.93 109.34 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.451 ' N ' HG12 ' A' ' 38' ' ' VAL . 1.7 t -60.52 -42.79 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 114.747 -1.115 . . . . 1.05 111.17 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.448 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.0 mt -67.11 -51.51 53.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.243 -0.28 . . . . 1.08 110.243 178.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -52.78 -30.94 35.84 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.178 -0.675 . . . . 0.24 109.178 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.482 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 66.2 m -73.16 -52.67 13.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.177 -0.92 . . . . 0.96 110.664 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.572 HG23 HD21 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -55.62 -29.37 59.05 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.88 0.371 . . . . 1.08 110.87 178.429 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -75.07 -51.86 12.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.102 -0.499 . . . . 1.52 110.661 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.23 -46.78 35.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.97 -0.559 . . . . 1.07 110.992 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.485 ' O ' HG13 ' A' ' 50' ' ' ILE . 3.9 pp -72.71 -40.66 65.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.325 -0.398 . . . . 1.04 110.173 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.42 ' N ' HD13 ' A' ' 46' ' ' LEU . 44.0 t -54.15 -36.21 63.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.089 0.471 . . . . 1.15 110.001 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.78 -34.49 64.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 1.95 109.793 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.02 -36.13 76.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.487 -0.56 . . . . 1.03 109.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.517 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -72.81 -32.3 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 N-CA-C 108.496 -0.927 . . . . 1.02 108.496 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -76.97 -15.29 59.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.118 -0.946 . . . . 1.01 109.389 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HA ' ' NE2' ' A' ' 56' ' ' GLN . 95.2 mtt180 -87.71 -15.32 37.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.512 -0.767 . . . . 3.48 110.934 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.451 HD21 ' N ' ' A' ' 59' ' ' SER . 5.9 t-20 -101.43 4.54 41.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 1.88 110.453 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 52.8 m -112.63 -37.06 5.02 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.137 -0.483 . . . . 2.69 111.418 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -105.33 -3.56 22.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.068 0.461 . . . . 3.68 110.547 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.524 HE21 ' N ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER -144.99 -148.7 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.599 -0.728 . . . . 4.31 109.662 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.8 66.86 1.36 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.885 0.374 . . . . 4.12 110.758 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.32 -98.73 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.066 -0.515 . . . . 1.92 110.91 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.451 ' N ' HD21 ' A' ' 53' ' ' ASN . 88.8 p -178.66 140.82 0.19 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.746 0.308 . . . . 2.47 111.051 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -71.44 -18.54 62.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.094 0.473 . . . . 1.87 109.744 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 48.2 t -78.8 -10.94 59.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.66 -0.7 . . . . 2.05 110.325 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.25 -46.18 23.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.582 . . . . 1.12 110.341 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.517 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -71.29 -25.71 25.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 1.13 109.235 178.534 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.612 HD23 ' NE2' ' A' ' 105' ' ' GLN . 1.7 tm? -75.63 -48.5 21.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.879 -1.055 . . . . 1.13 110.425 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -61.35 -52.23 65.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.609 0.718 . . . . 2.32 109.272 179.017 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.04 -26.84 67.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.588 -1.187 . . . . 1.01 108.448 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.86 -49.21 69.59 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.06 -0.973 . . . . 0.56 112.478 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.503 ' NZ ' HE22 ' A' ' 105' ' ' GLN . 1.0 OUTLIER -60.72 -43.72 97.52 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.864 0.364 . . . . 1.57 110.399 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.406 ' HB3' ' CZ ' ' A' ' 73' ' ' PHE . 17.6 m-80 -58.39 -42.19 86.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.878 -0.601 . . . . 0.53 110.777 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.572 HD21 HG23 ' A' ' 43' ' ' THR . 1.1 tm? -58.5 -48.66 80.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 2.06 110.223 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.467 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 47.8 t80 -60.62 -33.29 72.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 1.31 110.914 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.4 p -80.76 -16.77 52.96 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.207 0.447 . . . . 1.45 112.207 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.406 ' CZ ' ' HB3' ' A' ' 69' ' ' ASN . 24.3 m-85 -80.28 -44.29 19.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.506 -0.924 . . . . 0.46 108.506 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.439 ' O ' HG11 ' A' ' 78' ' ' VAL . 7.8 m -70.93 -27.4 63.74 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.337 -0.847 . . . . 1.54 109.15 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.467 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -64.57 -38.32 82.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-N 115.618 -0.719 . . . . 1.13 110.95 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.8 t -91.27 -11.71 37.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.922 0.392 . . . . 1.51 110.44 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.432 ' HB2' HG21 ' A' ' 34' ' ' ILE . 1.2 t80 -90.7 -26.58 19.48 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.919 -0.582 . . . . 0.8 111.929 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.492 HG12 ' HG2' ' A' ' 91' ' ' ARG . 2.8 m -63.06 -10.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 121.125 0.488 . . . . 1.54 111.044 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.0 6.67 3.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.958 -0.565 . . . . 1.31 110.598 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 41.1 t -126.66 -1.17 6.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.039 -0.528 . . . . 1.93 111.106 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.472 ' O ' ' N ' ' A' ' 83' ' ' GLN . 18.3 mm -40.74 -30.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 112.444 0.535 . . . . 1.39 112.444 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.537 ' C ' ' NE2' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 61.57 -72.36 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 123.767 0.667 . . . . 2.55 109.863 -178.175 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.672 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -49.02 156.5 0.51 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.256 -1.016 . . . . 3.3 108.256 179.371 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.431 ' C ' ' H ' ' A' ' 86' ' ' ASN . 1.4 ptm -122.48 -34.66 3.22 Favored 'General case' 0 C--N 1.314 -0.957 0 C-N-CA 120.019 -0.672 . . . . 3.25 112.723 -177.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.644 ' HG2' HE22 ' A' ' 83' ' ' GLN . 39.6 ptt180 -86.02 27.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.315 -0.624 . . . . 3.42 109.315 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.672 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -132.11 -29.47 1.63 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.9 -1.046 . . . . 2.49 110.77 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.55 ' N ' ' ND2' ' A' ' 86' ' ' ASN . 7.8 mttt -39.69 -50.19 2.3 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.731 -0.668 . . . . 2.88 111.519 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -56.39 -48.74 76.27 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.238 -0.437 . . . . 3.08 110.455 -179.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.09 -68.37 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.046 0.388 . . . . 1.17 112.046 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.529 ' O ' HG13 ' A' ' 94' ' ' ILE . 89.5 t80 -66.43 -50.23 64.09 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.429 0.899 . . . . 0.39 113.429 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.529 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -58.55 -47.86 82.81 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.339 -0.144 . . . . 3.9 111.308 -176.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -58.9 -37.88 77.61 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.651 -0.5 . . . . 2.58 109.651 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.18 -41.28 88.11 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.172 -0.677 . . . . 0.96 109.172 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 90' ' ' PHE . 40.4 mt -60.19 -42.75 91.39 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.289 -0.869 . . . . 1.09 109.039 178.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.602 ' ND2' ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.53 -44.79 89.69 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 114.556 -1.202 . . . . 0.33 109.666 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.602 ' HD2' ' ND2' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -48.44 -45.82 36.92 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.093 0.473 . . . . 2.3 109.783 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.675 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 0.2 OUTLIER -60.63 -40.75 93.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.76 . . . . 1.29 110.055 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -55.29 -61.29 2.43 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.707 -0.679 . . . . 1.87 111.627 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.442 ' ND2' ' O ' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -60.42 -35.44 75.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.907 -0.405 . . . . 2.12 109.907 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.577 HD21 HD22 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -58.93 -34.58 71.9 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.895 -0.779 . . . . 0.42 108.895 177.434 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 10.9 mt -71.06 -41.65 70.45 Favored 'General case' 0 C--N 1.34 0.171 0 N-CA-C 108.307 -0.997 . . . . 1.23 108.307 177.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 90.8 mtt180 -54.21 -47.85 71.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.693 -1.14 . . . . 2.63 111.478 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -79.01 -23.99 43.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.862 0.363 . . . . 2.32 110.66 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.415 HD23 HG23 ' A' ' 63' ' ' VAL . 36.3 tp -73.66 -15.8 61.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 1.08 111.334 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.612 ' NE2' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -51.26 163.36 0.25 Allowed 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 116.386 -0.37 . . . . 2.04 110.912 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.454 HG23 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -58.27 -50.91 76.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.374 -0.376 . . . . 2.22 111.022 -179.549 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' CYS . . . . . 0.456 ' SG ' ' HD2' ' A' ' 108' ' ' PRO . 35.5 t 61.59 141.17 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.271 0 CA-C-N 116.395 -0.366 . . . . 2.44 111.462 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.456 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 31.9 Cg_exo -58.7 -77.6 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.503 2.135 . . . . 3.01 112.41 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.481 ' HA ' ' HB3' ' A' ' 113' ' ' SER . . . -176.2 20.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.415 -0.357 . . . . 4.42 111.2 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 m -48.32 -50.94 28.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.955 -0.566 . . . . 5.66 111.351 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.59 33.36 0.7 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 5.83 111.168 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.06 88.9 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.831 -0.699 . . . . 5.65 112.508 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' A' ' 109' ' ' ALA . 41.1 t -129.81 105.19 7.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 4.62 111.19 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -156.8 -83.34 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.814 -0.708 . . . . 4.88 112.268 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.0 161.64 43.0 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.3 2.0 . . . . 6.39 111.954 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 57.99 -169.91 0.11 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.305 -0.407 . . . . 4.3 111.203 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -123.71 -55.26 1.72 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.264 -0.425 . . . . 3.13 110.849 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.4 p 43.65 87.05 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.351 0.596 . . . . 2.58 110.794 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.65 84.8 1.68 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.217 -0.901 . . . . 2.53 112.489 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -114.2 86.8 2.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 2.16 109.376 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.427 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 1.6 m-30 -83.05 43.72 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.61 112.021 -178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 89.7 p -67.93 -15.93 63.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 1.78 110.085 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -36.65 75.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.13 -0.693 . . . . 3.05 109.13 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.499 HD21 HD22 ' A' ' 100' ' ' ASN . 0.3 OUTLIER -65.6 -23.81 66.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.441 -0.948 . . . . 1.13 108.441 178.21 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.37 -48.62 32.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.877 -1.056 . . . . 1.99 110.309 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.2 t -66.59 -34.78 78.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.84 -0.618 . . . . 1.87 110.86 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.448 ' O ' HG13 ' A' ' 131' ' ' ILE . 67.5 m -62.44 -45.7 91.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.941 -0.572 . . . . 1.66 111.157 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.458 HG13 HG22 ' A' ' 43' ' ' THR . 46.1 t -60.52 -54.86 29.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 1.29 111.51 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -50.51 -38.94 47.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.96 -0.563 . . . . 3.15 111.39 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.09 -56.02 23.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.971 -0.558 . . . . 2.1 112.46 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 127' ' ' SER . 0.1 OUTLIER -52.36 -55.31 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.681 0.277 . . . . 1.11 111.13 -178.743 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.432 ' HB2' ' NE2' ' A' ' 136' ' ' GLN . 54.4 p -53.73 -47.42 70.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 1.44 111.004 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -53.01 -29.58 30.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.38 -0.373 . . . . 0.37 111.752 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.466 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 65.9 mt -79.3 -51.42 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.837 0.68 . . . . 1.08 112.837 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.516 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . 0.2 OUTLIER -57.57 -45.55 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.518 0.562 . . . . 1.01 112.518 -178.709 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . 0.432 ' NE2' ' HB2' ' A' ' 132' ' ' SER . 45.4 mt-30 -49.29 -49.19 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.465 -0.334 . . . . 0.91 111.737 -178.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.466 ' NH2' ' HA ' ' A' ' 134' ' ' ILE . 0.0 OUTLIER -78.28 -15.18 59.01 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.615 -0.513 . . . . 4.93 109.615 178.95 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 135' ' ' VAL . 0.5 OUTLIER -81.38 -79.19 0.17 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.47 -0.786 . . . . 2.5 110.622 179.636 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.245 -0.883 . . . . 4.17 110.956 179.717 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.475 HG22 ' HB2' ' A' ' 77' ' ' TYR . 49.6 mm . . . . . 0 N--CA 1.457 -0.115 0 CA-C-O 121.185 0.517 . . . . 0.39 111.918 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.4 p -131.75 -172.44 2.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.36 109.898 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.634 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -66.08 -33.55 76.04 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.541 -0.464 . . . . 0.99 110.073 179.404 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.402 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.78 -45.9 94.77 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 0.15 111.316 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.4 t -67.91 -39.97 82.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.657 0.741 . . . . 1.28 109.525 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -43.28 95.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.619 -1.173 . . . . 0.17 110.852 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.483 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 23.8 mt -60.98 -48.8 80.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.763 0.316 . . . . 0.21 110.543 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.69 -33.25 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.24 110.366 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.808 ' CB ' HD23 ' A' ' 70' ' ' LEU . 46.0 m -76.87 -35.41 57.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.34 111.47 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.483 ' OG1' ' HA ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -71.8 -33.39 68.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.971 0.415 . . . . 0.42 110.838 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -77.22 -48.88 16.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.02 -0.536 . . . . 1.52 110.776 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.93 -46.99 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.139 -0.482 . . . . 0.28 110.974 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.525 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.91 -38.44 79.58 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.306 -0.406 . . . . 0.3 110.247 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.525 ' N ' HD12 ' A' ' 46' ' ' LEU . 7.8 t -55.52 -35.68 65.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.004 0.431 . . . . 0.23 109.847 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.18 -34.21 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.826 -0.624 . . . . 1.2 109.834 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.32 -35.4 73.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.232 -0.655 . . . . 0.28 109.232 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.524 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.5 mt -72.11 -33.71 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.701 -0.852 . . . . 0.21 108.701 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -74.37 -12.82 60.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.041 -0.982 . . . . 0.45 109.6 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 . . . . . 0 N--CA 1.456 -0.172 0 CA-C-N 115.364 -0.834 . . . . 2.91 110.98 -179.992 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 . . . . . 0 N--CA 1.457 -0.077 0 N-CA-C 109.887 -0.412 . . . . 1.3 109.887 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.5 m -76.9 -3.22 37.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.754 -0.657 . . . . 1.58 110.848 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.73 -53.73 5.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.094 0.473 . . . . 0.33 109.891 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.524 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -69.64 -28.97 39.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.21 109.701 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.634 HD21 ' NE2' ' A' ' 105' ' ' GLN . 0.6 OUTLIER -72.23 -53.42 12.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.841 -1.072 . . . . 0.24 110.98 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.37 -49.37 78.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.302 0.572 . . . . 2.32 109.894 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.24 -27.32 67.12 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.368 -0.975 . . . . 0.29 108.368 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.437 ' HA3' HD22 ' A' ' 101' ' ' LEU . . . -61.75 -47.54 89.71 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.746 -1.116 . . . . 0.4 112.582 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.438 ' HD2' HD13 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -65.81 -41.36 91.97 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.574 0.226 . . . . 0.83 111.224 -179.535 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . 0.419 ' O ' ' HB2' ' A' ' 72' ' ' SER . 19.7 m-80 -58.42 -43.16 88.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.91 0.386 . . . . 0.53 110.953 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.808 HD23 ' CB ' ' A' ' 42' ' ' SER . 3.2 tm? -64.7 -50.21 67.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.977 -0.556 . . . . 1.41 111.133 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.41 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 7.2 t80 -56.52 -33.27 65.88 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.679 -0.86 . . . . 0.75 108.679 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 70.6 m -65.17 -50.6 65.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.012 -0.994 . . . . 1.13 111.001 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.455 ' HB3' HG23 ' A' ' 34' ' ' ILE . 11.5 m-85 -62.17 -43.64 98.39 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.363 -0.535 . . . . 0.28 111.639 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -51.19 70.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.263 -0.426 . . . . 0.9 110.896 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.36 -37.79 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 112.527 0.566 . . . . 0.43 112.527 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -86.4 -10.27 54.64 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.056 0.455 . . . . 0.9 110.866 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.475 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -91.91 -23.55 19.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.787 -0.642 . . . . 0.25 111.778 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.0 OUTLIER -72.81 -11.44 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.949 0.404 . . . . 0.98 111.574 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -71.9 -3.61 23.47 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 1.31 109.681 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -110.64 1.97 18.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.45 -0.795 . . . . 1.49 111.459 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.621 HG21 ' HB2' ' A' ' 87' ' ' LYS . 23.3 mm -66.31 115.78 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 120.528 -0.469 . . . . 1.39 110.172 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.551 ' O ' ' HG3' ' A' ' 84' ' ' MET . 0.0 OUTLIER -84.67 -29.11 25.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 121.087 0.47 . . . . 2.55 110.099 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.524 ' HB3' ' OD1' ' A' ' 86' ' ' ASN . 15.0 mm100 -46.52 -47.08 19.55 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.26 -0.882 . . . . 2.56 113.101 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.551 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 43.3 mtm 81.91 -91.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.763 0.653 . . . . 2.71 112.763 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -64.75 0.92 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.886 0.374 . . . . 2.78 111.736 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -114.61 -17.97 11.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.067 -0.716 . . . . 2.49 109.067 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.621 ' HB2' HG21 ' A' ' 81' ' ' ILE . 0.6 OUTLIER -58.77 -35.65 73.11 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.173 -0.921 . . . . 2.28 109.289 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.463 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 71.1 m-85 -56.98 -44.25 82.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.574 -0.739 . . . . 2.49 110.026 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -53.77 -61.82 2.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 0.35 112.085 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.654 ' CE2' HD11 ' A' ' 94' ' ' ILE . 66.9 t80 -63.23 -45.59 90.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.28 111.559 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.595 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.2 OUTLIER -58.15 -52.44 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 3.34 111.723 -178.139 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 11.0 pt-20 -54.94 -36.46 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.192 -0.299 . . . . 2.58 110.192 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.06 -40.03 88.09 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.665 0.745 . . . . 0.29 109.123 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.654 HD11 ' CE2' ' A' ' 90' ' ' PHE . 32.9 mt -61.81 -41.2 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.174 -0.921 . . . . 0.24 109.018 178.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.51 -39.11 79.18 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.589 -1.187 . . . . 0.33 109.292 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 1.3 mptm? -54.4 -47.5 72.67 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.752 -0.462 . . . . 1.64 109.752 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.724 ' CD2' HD12 ' A' ' 70' ' ' LEU . 33.7 tp -59.95 -32.27 70.64 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.631 -0.427 . . . . 0.62 110.197 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -58.64 -60.14 4.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.144 -0.48 . . . . 1.87 110.736 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.441 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 0.9 OUTLIER -73.57 -10.22 59.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 2.12 111.474 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.492 HD22 HD22 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -76.9 -47.86 19.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.723 -0.843 . . . . 0.26 108.723 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 8.2 mt -66.42 -31.92 72.97 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.234 -0.894 . . . . 0.58 108.659 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.441 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 87.1 mtt180 -54.69 -55.76 26.41 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.092 -0.958 . . . . 2.09 110.764 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -71.89 -18.99 62.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.979 0.418 . . . . 2.32 110.495 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.497 HD11 ' CE2' ' A' ' 121' ' ' PHE . 32.9 tp -79.53 -18.18 52.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.941 -0.572 . . . . 0.31 111.225 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.634 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.217 0 CA-C-N 116.483 -0.326 . . . . 2.04 111.322 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.497 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.5 m-30 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.733 0.272 . . . . 0.47 111.733 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' SER . . . . . 0.548 ' HB2' ' HZ1' ' A' ' 123' ' ' LYS . 31.0 m -71.64 -14.28 62.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.938 -0.305 . . . . 1.26 110.605 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.548 ' HZ1' ' HB2' ' A' ' 122' ' ' SER . 0.1 OUTLIER -69.64 -44.21 71.06 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.198 -0.668 . . . . 2.58 109.198 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.526 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.1 OUTLIER -59.61 -25.44 64.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.376 -0.829 . . . . 0.26 108.771 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tp -73.88 -48.19 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.134 -0.939 . . . . 1.3 110.636 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.5 t -63.91 -35.82 81.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.131 -0.486 . . . . 1.4 111.123 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 131' ' ' ILE . 65.6 m -65.58 -46.74 78.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.541 . . . . 1.09 111.91 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.45 HG13 ' HB ' ' A' ' 43' ' ' THR . 55.3 t -62.89 -55.43 23.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 0.51 111.537 -178.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -50.61 -40.68 53.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.764 -0.653 . . . . 2.69 111.017 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.5 -55.31 36.64 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.837 -0.62 . . . . 2.1 112.061 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.583 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.24 -56.14 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 120.735 0.303 . . . . 0.29 111.157 -178.857 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 30.7 t -56.61 -47.6 79.27 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.262 -0.426 . . . . 1.02 110.758 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -50.18 -26.73 4.91 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.922 -0.581 . . . . 0.37 112.28 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.1 mt -86.29 -51.21 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 113.131 0.789 . . . . 0.26 113.131 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.634 HG21 ' HG3' ' A' ' 36' ' ' LYS . 1.4 p -53.98 -47.56 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 113.897 1.073 . . . . 0.25 113.897 -177.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 . . . . . 0 C--N 1.326 -0.453 0 C-N-CA 120.636 -0.426 . . . . 0.91 111.709 -178.363 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.69 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.4 mm . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 121.241 0.543 . . . . 0.39 111.814 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.532 ' O ' HG12 ' A' ' 38' ' ' VAL . 81.2 p -123.45 -160.27 0.9 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.427 -0.806 . . . . 0.36 109.179 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.652 ' HB2' HG21 ' A' ' 135' ' ' VAL . 6.5 ttpt -69.78 -39.97 76.3 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.206 -0.597 . . . . 0.99 109.426 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -52.18 -49.6 49.5 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.251 -0.886 . . . . 0.15 112.861 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.69 HG11 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -65.82 -38.67 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.606 0.717 . . . . 1.28 109.565 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.428 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.3 t -62.64 -38.11 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.578 -1.192 . . . . 0.17 111.181 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.0 mt -68.18 -51.41 46.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.062 -0.347 . . . . 0.21 110.062 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.48 -31.02 21.97 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.315 -0.624 . . . . 0.24 109.315 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.2 m -73.96 -44.33 55.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.301 -0.863 . . . . 0.34 110.7 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.849 HG22 HG22 ' A' ' 128' ' ' VAL . 3.6 p -60.2 -37.7 81.04 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 120.865 0.364 . . . . 0.42 111.049 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.46 -52.91 27.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 1.52 111.29 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.12 -47.11 34.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.28 111.572 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.794 HD21 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -74.91 -40.26 60.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.45 -0.341 . . . . 0.3 110.742 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.437 ' N ' HD12 ' A' ' 46' ' ' LEU . 44.1 t -55.46 -39.96 71.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.048 0.451 . . . . 0.23 110.276 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -70.3 -35.01 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 1.2 109.948 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.04 81.38 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.702 -0.481 . . . . 0.28 109.702 178.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.632 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.0 mt -70.72 -30.18 41.04 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 N-CA-C 108.785 -0.82 . . . . 0.21 108.785 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -79.15 -13.8 59.5 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.117 -0.947 . . . . 0.45 109.649 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.375 -0.829 . . . . 2.91 111.439 -179.612 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 109.861 -0.422 . . . . 1.3 109.861 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -78.08 -10.88 59.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.729 -0.669 . . . . 1.58 110.27 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.28 -45.94 24.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.33 110.206 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.632 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.13 -29.55 21.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.21 109.896 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.677 HD23 HD23 ' A' ' 104' ' ' LEU . 1.2 tm? -74.35 -51.24 15.67 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.992 -1.004 . . . . 0.24 111.18 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.31 -49.47 71.62 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.154 0.502 . . . . 2.32 109.799 179.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.96 -27.41 67.44 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.258 -1.015 . . . . 0.29 108.258 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -65.08 -46.42 88.63 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.795 -1.093 . . . . 0.4 112.253 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.497 ' HZ1' HD11 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -61.28 -43.94 98.04 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.847 0.356 . . . . 0.83 110.559 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -58.44 -41.95 86.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.53 111.033 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.794 HD22 HD21 ' A' ' 46' ' ' LEU . 12.9 tp -61.52 -47.69 84.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.2 -0.455 . . . . 1.41 110.432 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.592 ' HB2' HD23 ' A' ' 97' ' ' LEU . 10.5 t80 -57.94 -35.42 71.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.933 -0.576 . . . . 0.75 110.228 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 53.1 p -80.23 -18.62 48.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 1.13 112.399 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -80.31 -44.44 19.55 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.326 -0.99 . . . . 0.28 108.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 77' ' ' TYR . 3.8 m -68.99 -27.08 65.37 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.502 -0.772 . . . . 0.9 109.118 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.475 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.5 OUTLIER -66.14 -37.78 80.51 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.615 -0.721 . . . . 0.43 110.801 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.5 t -91.06 -9.66 44.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.996 0.426 . . . . 0.9 110.07 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.503 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -90.77 -28.35 18.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.634 -0.712 . . . . 0.25 111.454 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.44 ' HA ' HG12 ' A' ' 81' ' ' ILE . 3.4 m -66.1 -11.39 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.96 0.409 . . . . 0.98 111.663 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -71.05 -2.9 17.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 1.31 110.811 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 57.4 p -119.19 3.56 11.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.977 -0.556 . . . . 1.49 111.924 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.473 HG21 ' CA ' ' A' ' 87' ' ' LYS . 11.9 mm -55.22 -33.06 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 111.956 0.354 . . . . 1.39 111.956 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 84' ' ' MET . 5.6 tm0? 61.96 -66.65 0.07 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.565 0.95 . . . . 2.55 113.565 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.515 ' O ' ' N ' ' A' ' 85' ' ' ARG . 34.4 mt-30 -46.03 -9.33 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.97 1.1 . . . . 2.56 113.97 -177.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.546 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 7.5 ptt? 48.43 -69.92 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.566 1.321 . . . . 2.71 114.566 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 83' ' ' GLN . 34.0 ttm180 -48.97 -40.87 32.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.568 0.622 . . . . 2.78 110.729 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 87' ' ' LYS . 21.1 p-10 -73.3 -28.2 61.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.692 -0.686 . . . . 2.49 110.631 179.237 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.602 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -56.72 -37.05 70.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.027 -0.533 . . . . 2.28 111.021 -179.336 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -57.03 -48.5 78.35 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.578 -0.449 . . . . 2.49 110.067 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.91 -65.6 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.955 -0.566 . . . . 0.35 111.875 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.594 ' CE1' HG22 ' A' ' 131' ' ' ILE . 68.0 t80 -62.83 -47.4 83.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.535 0.569 . . . . 0.28 112.535 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.602 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.8 OUTLIER -57.99 -56.52 20.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.686 -0.233 . . . . 3.34 111.32 -177.446 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.7 pt-20 -52.38 -36.18 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.886 -0.413 . . . . 2.58 109.886 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -61.45 -38.91 88.92 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.366 -0.605 . . . . 0.29 109.366 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.573 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -62.26 -40.93 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 N-CA-C 108.724 -0.843 . . . . 0.24 108.724 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASN . . . . . 0.402 ' O ' ' ND2' ' A' ' 99' ' ' ASN . 0.1 OUTLIER -58.65 -42.53 88.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.444 -1.253 . . . . 0.33 109.225 179.238 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -52.92 -40.94 63.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.501 -0.555 . . . . 1.64 109.501 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.593 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 15.5 tp -65.3 -35.79 82.07 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.888 -0.596 . . . . 0.62 110.238 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -53.63 -61.37 2.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.076 0.465 . . . . 1.87 110.383 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.463 ' H ' ' ND2' ' A' ' 99' ' ' ASN . 0.4 OUTLIER -63.35 -40.62 97.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.669 -0.696 . . . . 2.12 111.156 179.054 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.537 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -49.45 -45.56 46.8 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.957 0.408 . . . . 0.26 110.051 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 4.8 mt -68.27 -39.55 82.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.792 -0.64 . . . . 0.58 109.537 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 47.0 mtp180 -54.59 -48.48 72.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.237 -0.892 . . . . 2.09 111.307 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.84 -21.35 55.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.087 0.47 . . . . 2.32 110.19 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.677 HD23 HD23 ' A' ' 64' ' ' LEU . 22.2 tp -77.79 -11.92 59.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.632 -0.713 . . . . 0.31 110.916 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.496 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 116.049 -0.523 . . . . 2.04 111.146 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.436 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 111.871 0.323 . . . . 0.47 111.871 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 58.7 m -66.45 -15.26 63.2 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.837 -0.345 . . . . 1.26 110.221 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.437 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.41 -40.11 67.42 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.123 -0.695 . . . . 2.58 109.123 178.752 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 124' ' ' LEU . 1.7 tp -65.5 -15.97 63.2 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.895 -0.78 . . . . 0.26 108.895 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.81 -48.18 13.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.173 -0.922 . . . . 1.3 110.15 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.9 p -73.54 -29.36 62.4 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 1.4 110.741 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.0 t -69.32 -49.13 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.883 -0.599 . . . . 1.09 110.691 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.849 HG22 HG22 ' A' ' 43' ' ' THR . 0.3 OUTLIER -61.25 -42.15 92.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 115.372 -0.831 . . . . 0.51 110.832 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -64.35 -33.9 76.9 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.878 -0.601 . . . . 2.69 110.404 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -59.59 -46.53 88.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.761 -0.654 . . . . 2.1 110.751 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.594 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.5 OUTLIER -57.25 -55.65 19.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.923 0.392 . . . . 0.29 110.464 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 135' ' ' VAL . 1.4 t -53.68 -42.74 68.27 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.911 -0.586 . . . . 1.02 110.809 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.77 -37.89 77.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.998 -0.546 . . . . 0.37 112.066 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 72.8 mt -64.46 -53.1 46.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 112.057 0.392 . . . . 0.26 112.057 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.652 HG21 ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.05 -40.8 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 N-CA-C 112.793 0.664 . . . . 0.25 112.793 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 111.935 0.346 . . . . 0.91 111.935 -178.832 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.681 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.1 mm . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.335 0.588 . . . . 0.39 112.152 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.525 ' O ' HG12 ' A' ' 38' ' ' VAL . 72.0 p -124.02 -160.35 0.92 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.319 -0.855 . . . . 0.36 109.342 178.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.626 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -75.5 -27.14 58.67 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.467 -0.568 . . . . 0.99 109.467 178.443 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.64 -46.58 93.43 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.46 -0.791 . . . . 0.15 111.832 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.681 HG11 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -68.88 -36.03 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.688 0.756 . . . . 1.28 109.29 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.403 HG22 ' SG ' ' A' ' 74' ' ' CYS . 1.5 t -63.26 -43.66 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.467 -1.242 . . . . 0.17 110.764 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.498 HD12 ' HE3' ' A' ' 36' ' ' LYS . 26.4 mt -61.73 -51.12 69.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.798 0.332 . . . . 0.21 110.254 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -54.64 -30.09 54.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.24 110.166 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.793 ' HB2' HD23 ' A' ' 70' ' ' LEU . 70.2 m -79.38 -36.79 38.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.624 -0.716 . . . . 0.34 111.456 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.568 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -71.33 -26.93 63.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.177 0.513 . . . . 0.42 109.802 178.698 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -80.85 -45.74 16.39 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.592 -0.731 . . . . 1.52 109.956 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.91 -47.26 52.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.928 -0.578 . . . . 0.28 111.043 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.565 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -72.66 -39.28 67.25 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.726 -0.39 . . . . 0.3 110.056 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.565 ' N ' HD12 ' A' ' 46' ' ' LEU . 51.9 t -54.2 -42.25 69.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.128 -0.487 . . . . 0.23 110.276 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -38.4 81.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.77 -0.65 . . . . 1.2 109.682 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . -57.25 -28.97 63.42 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.28 109.803 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -75.88 -39.37 37.78 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 108.888 -0.782 . . . . 0.21 108.888 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t -73.13 -10.04 59.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.273 -0.876 . . . . 0.45 109.595 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 21.0 mmt180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.159 -0.928 . . . . 2.91 110.437 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 121.09 0.471 . . . . 1.3 109.755 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -75.08 -10.4 59.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.618 -0.719 . . . . 1.58 110.473 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.92 -48.41 14.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.044 -0.526 . . . . 0.33 110.098 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.463 ' CG2' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -73.17 -35.79 48.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.277 -0.638 . . . . 0.21 109.277 178.441 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.627 HD23 HD23 ' A' ' 104' ' ' LEU . 2.0 tm? -64.15 -54.9 26.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.037 -0.983 . . . . 0.24 110.689 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.08 -48.88 78.23 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.258 -0.428 . . . . 2.32 111.726 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.2 -25.1 65.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.066 -0.516 . . . . 0.29 110.893 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.559 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -83.55 -30.15 30.78 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.176 -1.011 . . . . 0.4 112.402 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.77 ' HD2' HD13 ' A' ' 101' ' ' LEU . 15.7 mmmt -63.99 -35.23 80.01 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.977 -1.12 . . . . 0.83 107.977 177.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -70.0 -43.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.479 -1.237 . . . . 0.53 109.9 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.854 HD12 HD22 ' A' ' 97' ' ' LEU . 3.4 tm? -59.08 -48.1 82.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.298 -0.864 . . . . 1.41 110.147 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.555 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 10.7 t80 -61.14 -33.25 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.908 -0.587 . . . . 0.75 109.64 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 t -73.29 -26.85 61.24 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.673 -0.694 . . . . 1.13 112.03 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -81.61 -43.55 18.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 119.725 -0.79 . . . . 0.28 109.452 -178.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.403 ' SG ' HG22 ' A' ' 39' ' ' VAL . 15.4 m -64.31 -43.8 93.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.704 -0.68 . . . . 0.9 109.672 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.93 -39.75 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.955 -0.566 . . . . 0.43 111.995 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.4 t -86.73 -11.21 51.78 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.997 -0.681 . . . . 0.9 110.441 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.522 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.6 OUTLIER -90.68 -23.96 20.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.755 -0.657 . . . . 0.25 112.146 -179.395 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.49 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.6 m -70.28 -8.4 10.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.182 0.515 . . . . 0.98 111.221 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -74.77 -0.99 20.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.861 -0.609 . . . . 1.31 110.357 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 80.2 p -114.05 4.79 15.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.962 -0.563 . . . . 1.49 111.325 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.607 HG21 ' HB2' ' A' ' 87' ' ' LYS . 25.0 mm -70.4 92.88 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 116.474 -0.33 . . . . 1.39 111.197 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.532 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -59.81 -34.76 73.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.781 -0.822 . . . . 2.55 108.781 178.976 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.532 ' N ' ' HG3' ' A' ' 82' ' ' GLN . 19.5 mp0 -60.82 172.14 1.02 Allowed 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 114.905 -1.043 . . . . 2.56 109.969 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 4.9 ptm -144.06 -43.77 0.26 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.326 -0.397 . . . . 2.71 111.335 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -81.99 9.69 7.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.665 0.745 . . . . 2.78 109.045 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.475 ' OD1' ' HB3' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -126.89 -32.51 2.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.587 -1.188 . . . . 2.49 110.041 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.607 ' HB2' HG21 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -50.65 -44.63 57.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.387 -0.824 . . . . 2.28 111.067 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.522 ' N ' ' HD2' ' A' ' 87' ' ' LYS . 2.2 p90 -56.89 -46.8 81.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.4 0.619 . . . . 2.49 110.219 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -52.77 -59.7 4.17 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.949 -1.023 . . . . 0.35 112.193 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.622 ' CE1' HG22 ' A' ' 131' ' ' ILE . 68.8 t80 -66.13 -48.09 71.96 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.263 0.468 . . . . 0.28 112.263 -179.083 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.516 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.5 OUTLIER -56.61 -52.92 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.462 -0.335 . . . . 3.34 110.795 -177.728 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.5 pt-20 -55.52 -36.87 67.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 2.58 110.382 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.2 -39.25 85.88 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.433 0.635 . . . . 0.29 109.731 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.604 HD11 ' CE2' ' A' ' 90' ' ' PHE . 21.2 mt -62.63 -40.97 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.404 0 CA-C-N 115.357 -0.838 . . . . 0.24 108.806 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASN . . . . . 0.45 ' OD1' ' HD2' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -58.51 -40.83 83.97 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.497 -1.229 . . . . 0.33 109.186 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 11.0 mptt -51.95 -49.89 62.26 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.374 -0.375 . . . . 1.64 110.133 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.854 HD22 HD12 ' A' ' 70' ' ' LEU . 30.7 tp -58.44 -32.25 68.53 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 116.079 -0.51 . . . . 0.62 110.606 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.59 -60.08 4.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.373 -0.376 . . . . 1.87 110.495 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -72.59 -10.04 59.31 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.119 -0.491 . . . . 2.12 111.587 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.465 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.72 -43.95 21.68 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.37 -0.974 . . . . 0.26 108.37 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.77 HD13 ' HD2' ' A' ' 68' ' ' LYS . 10.5 mt -68.11 -33.19 74.05 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.053 -0.976 . . . . 0.58 108.45 178.106 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -54.95 -55.55 29.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.854 -1.066 . . . . 2.09 110.534 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -71.76 -21.95 61.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.001 0.429 . . . . 2.32 110.575 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.627 HD23 HD23 ' A' ' 64' ' ' LEU . 29.3 tp -77.77 -17.99 56.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.31 111.339 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.509 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.322 -0.399 . . . . 2.04 111.234 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.517 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.162 0 N-CA-C 111.951 0.352 . . . . 0.47 111.951 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 43.9 m -66.82 -15.91 63.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.917 -0.401 . . . . 1.26 109.917 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.452 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 3.0 mppt? -70.89 -44.38 66.42 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.715 -0.846 . . . . 2.58 108.715 178.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.496 HD12 ' O ' ' A' ' 124' ' ' LEU . 1.4 tp -60.23 -22.1 62.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.463 -0.789 . . . . 0.26 108.945 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -48.81 29.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.258 -0.883 . . . . 1.3 109.872 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.1 m -67.12 -31.68 72.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.703 -0.681 . . . . 1.4 110.667 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.473 ' O ' HG13 ' A' ' 131' ' ' ILE . 68.6 m -66.98 -41.73 86.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 1.09 111.218 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.568 HG13 ' HB ' ' A' ' 43' ' ' THR . 26.2 t -63.42 -56.16 18.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.13 -0.486 . . . . 0.51 111.074 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.0 mmtt -52.67 -36.48 57.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.56 -0.746 . . . . 2.69 111.341 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.408 ' O ' HG13 ' A' ' 134' ' ' ILE . 40.3 tt0 -62.5 -51.61 66.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.106 -0.497 . . . . 2.1 112.278 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.622 HG22 ' CE1' ' A' ' 90' ' ' PHE . 1.3 mt -55.23 -55.23 17.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 C-N-CA 120.942 -0.303 . . . . 0.29 110.96 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.1 p -55.21 -45.77 75.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 1.02 111.275 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.79 -31.29 58.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.37 111.739 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.491 HG21 ' N ' ' A' ' 90' ' ' PHE . 91.1 mt -74.78 -51.25 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 112.877 0.695 . . . . 0.26 112.877 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.626 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.57 -41.62 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 112.296 0.48 . . . . 0.25 112.296 -179.056 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.309 -0.405 . . . . 0.91 111.848 -178.852 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.633 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.0 mm . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 121.361 0.601 . . . . 0.39 112.065 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.551 ' O ' HG12 ' A' ' 38' ' ' VAL . 77.5 p -129.55 -159.42 0.96 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.291 -0.868 . . . . 0.36 109.483 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.685 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.3 -30.86 60.49 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.384 -0.527 . . . . 0.99 109.733 178.463 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -60.85 -46.14 95.12 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.539 -0.755 . . . . 0.15 112.046 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.633 HG11 ' HA ' ' A' ' 34' ' ' ILE . 10.8 p -66.97 -39.3 83.14 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 1.28 109.522 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.446 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -63.23 -43.38 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 114.825 -1.079 . . . . 0.17 110.876 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.473 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.2 mt -63.11 -46.85 85.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.71 0.29 . . . . 0.21 110.521 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.9 -32.63 67.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.966 0.412 . . . . 0.24 110.224 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.803 ' CB ' HD23 ' A' ' 70' ' ' LEU . 39.3 m -77.47 -35.45 53.79 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.747 -0.661 . . . . 0.34 111.371 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.478 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.3 OUTLIER -73.31 -26.6 61.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.509 . . . . 0.42 109.816 178.545 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -79.11 -47.26 16.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.509 -0.769 . . . . 1.52 110.161 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.51 -47.29 63.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.054 -0.521 . . . . 0.28 111.024 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.616 HD22 ' HA2' ' A' ' 67' ' ' GLY . 4.2 pp -69.97 -40.28 75.48 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.821 -0.352 . . . . 0.3 110.182 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.549 ' N ' HD12 ' A' ' 46' ' ' LEU . 53.9 t -57.31 -41.69 80.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.043 -0.526 . . . . 0.23 110.889 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mp -65.88 -39.86 91.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 1.2 110.238 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.84 -39.65 71.71 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.78 -0.452 . . . . 0.28 109.78 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -70.12 -38.5 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.228 0 N-CA-C 108.902 -0.777 . . . . 0.21 108.902 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -71.14 -14.55 62.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.45 109.18 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-N 115.266 -0.879 . . . . 2.91 111.137 -179.944 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.954 0.407 . . . . 1.3 110.013 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -77.61 -5.11 49.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 1.58 111.17 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.97 -48.98 10.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.973 0.416 . . . . 0.33 110.515 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.531 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -68.05 -39.48 81.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.826 -0.624 . . . . 0.21 110.258 179.334 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 104' ' ' LEU . 1.1 tm? -65.02 -56.06 15.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.442 -0.799 . . . . 0.24 111.224 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.14 -44.04 95.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.342 -0.39 . . . . 2.32 111.596 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.63 -45.71 85.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.041 -0.527 . . . . 0.29 111.063 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.616 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -62.87 -31.36 80.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.335 -0.936 . . . . 0.4 112.578 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -44.31 96.14 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.464 -0.939 . . . . 0.83 108.464 177.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -62.68 -38.63 91.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.61 -1.177 . . . . 0.53 110.341 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.803 HD23 ' CB ' ' A' ' 42' ' ' SER . 2.8 tm? -65.77 -49.97 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.472 -0.785 . . . . 1.41 111.069 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -53.6 -34.88 59.99 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.735 -0.839 . . . . 0.75 108.735 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.0 m -68.46 -49.67 58.14 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.042 -0.981 . . . . 1.13 111.444 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -57.25 -43.57 83.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.92 -0.712 . . . . 0.28 110.581 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.457 ' O ' HG13 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -60.74 -29.33 69.31 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.766 -0.652 . . . . 0.9 109.838 178.578 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -37.13 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.489 -0.778 . . . . 0.43 111.36 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.3 t -89.59 -9.03 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.9 110.977 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.523 ' HB2' HG22 ' A' ' 34' ' ' ILE . 1.6 t80 -94.63 -29.6 14.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.0 -0.545 . . . . 0.25 111.614 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.475 ' O ' HG12 ' A' ' 81' ' ' ILE . 3.6 m -61.65 -11.92 6.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.148 0.499 . . . . 0.98 111.034 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -80.19 8.67 6.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.769 -0.65 . . . . 1.31 109.877 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 58.5 m -117.53 -8.99 10.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.694 -0.685 . . . . 1.49 110.693 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.56 HG21 ' HG3' ' A' ' 87' ' ' LYS . 34.6 mm -56.91 106.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 116.106 -0.497 . . . . 1.39 110.869 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.484 ' HG3' ' H ' ' A' ' 83' ' ' GLN . 1.3 pp0? -67.93 -48.39 66.09 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.936 0.398 . . . . 2.55 110.133 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.484 ' H ' ' HG3' ' A' ' 82' ' ' GLN . 75.5 mt-30 -59.31 -174.55 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.77 -0.65 . . . . 2.56 109.955 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -152.46 -40.34 0.11 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.349 -0.54 . . . . 2.71 111.582 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -73.78 -1.9 21.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.642 0.734 . . . . 2.78 109.052 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.438 ' OD1' ' N ' ' A' ' 87' ' ' LYS . 1.5 p-10 -115.65 -25.57 7.79 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.943 -1.026 . . . . 2.49 110.611 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.56 ' HG3' HG21 ' A' ' 81' ' ' ILE . 1.0 OUTLIER -45.47 -48.93 13.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.798 -0.637 . . . . 2.28 111.083 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -56.2 -43.0 78.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.793 -0.64 . . . . 2.49 110.75 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -55.24 -61.24 2.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.271 0.471 . . . . 0.35 112.271 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.651 ' CE2' HD11 ' A' ' 94' ' ' ILE . 88.9 t80 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.195 0.442 . . . . 0.28 112.195 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.06 -55.03 31.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 3.34 110.654 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.4 pt-20 -58.55 -34.3 70.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 2.58 110.564 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -59.99 -37.99 81.29 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.494 0.664 . . . . 0.29 109.823 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.651 HD11 ' CE2' ' A' ' 90' ' ' PHE . 11.0 mt -66.11 -36.22 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 115.336 -0.847 . . . . 0.24 109.123 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASN . . . . . 0.481 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 0.1 OUTLIER -61.74 -32.09 72.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.86 -1.063 . . . . 0.33 109.22 179.115 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 0.7 OUTLIER -63.89 -48.67 75.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.526 -0.546 . . . . 1.64 109.526 178.581 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.743 ' CD2' HD12 ' A' ' 70' ' ' LEU . 23.5 tp -58.11 -33.59 69.29 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 116.165 -0.47 . . . . 0.62 109.951 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.494 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 7.5 tp10 -57.75 -59.24 5.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.892 -0.594 . . . . 1.87 110.424 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.566 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 29.3 m-80 -72.75 -9.93 59.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 2.12 111.181 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.5 ' OD1' HD13 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -78.41 -47.94 16.51 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 108.683 -0.858 . . . . 0.26 108.683 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 5.9 mt -65.5 -34.44 78.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.323 -0.991 . . . . 0.58 108.323 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.566 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 98.2 mtt180 -55.49 -50.03 70.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.942 -1.026 . . . . 2.09 111.256 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.75 -22.13 50.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.106 0.479 . . . . 2.32 110.136 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 64' ' ' LEU . 42.0 tp -69.37 -17.31 63.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.721 -0.672 . . . . 0.31 110.83 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.497 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.168 0 CA-C-O 120.769 0.319 . . . . 2.04 110.517 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.468 ' HB2' HG21 ' A' ' 50' ' ' ILE . 2.0 m-30 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 112.234 0.457 . . . . 0.47 112.234 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 96.4 p -73.18 -17.15 61.4 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.702 -0.481 . . . . 1.26 109.702 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 123' ' ' LYS . 29.8 mmmt -66.83 -52.61 41.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 109.135 -0.691 . . . . 2.58 109.135 178.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.8 OUTLIER -51.41 -27.04 9.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.001 -0.999 . . . . 0.26 109.049 177.544 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.46 -49.71 38.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.266 -0.879 . . . . 1.3 110.214 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 89.7 p -64.43 -34.26 77.78 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.903 -0.59 . . . . 1.4 111.128 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 t -62.31 -46.88 86.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 1.09 111.529 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.478 HG13 ' HB ' ' A' ' 43' ' ' THR . 53.8 t -60.87 -50.23 81.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.51 111.311 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -50.71 -43.82 57.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.035 -0.53 . . . . 2.69 110.92 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.414 ' O ' HG13 ' A' ' 134' ' ' ILE . 10.9 tp10 -59.26 -55.47 34.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.638 -0.71 . . . . 2.1 112.79 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.585 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.0 OUTLIER -51.36 -55.07 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-O 120.826 0.346 . . . . 0.29 111.299 -178.497 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 41.2 t -53.61 -48.4 69.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.11 -0.496 . . . . 1.02 111.048 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.87 -29.84 30.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.103 0.408 . . . . 0.37 112.103 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 130' ' ' GLU . 65.7 mt -76.8 -51.31 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 113.012 0.745 . . . . 0.26 113.012 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.685 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -58.03 -44.9 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.536 0.939 . . . . 0.25 113.536 -178.172 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 . . . . . 0 C--N 1.321 -0.637 0 N-CA-C 112.825 0.676 . . . . 0.91 112.825 -177.913 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.457 HG22 ' HB2' ' A' ' 77' ' ' TYR . 50.7 mm . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 121.151 0.5 . . . . 0.39 111.954 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.7 p -127.95 -175.95 3.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.626 -0.715 . . . . 0.36 109.649 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.623 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.74 -34.29 77.83 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.372 -0.531 . . . . 0.99 109.775 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.448 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.0 -43.71 98.8 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.676 -0.773 . . . . 0.15 111.2 178.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.1 t -69.08 -40.36 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.591 0.71 . . . . 1.28 109.559 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.26 -44.16 97.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.639 -1.164 . . . . 0.17 110.826 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.466 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 25.1 mt -60.58 -47.4 86.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.722 0.296 . . . . 0.21 110.602 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -56.35 -31.47 63.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.24 110.219 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.779 ' CB ' HD23 ' A' ' 70' ' ' LEU . 41.8 m -77.86 -34.85 51.53 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.761 -0.654 . . . . 0.34 111.277 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.476 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.2 OUTLIER -73.43 -29.14 62.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.42 109.805 178.56 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -79.23 -45.76 19.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.698 -0.683 . . . . 1.52 110.218 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.61 -47.19 63.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.043 -0.526 . . . . 0.28 110.786 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.583 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.24 -39.97 82.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.526 -0.47 . . . . 0.3 110.055 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.583 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.9 t -56.85 -41.45 77.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.211 -0.45 . . . . 0.23 110.756 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.71 -39.15 90.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 1.2 110.191 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.68 -34.11 69.07 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.408 -0.59 . . . . 0.28 109.408 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.585 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -72.17 -30.33 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 109.037 -0.727 . . . . 0.21 109.037 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -81.62 -13.16 58.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.158 -0.928 . . . . 0.45 109.689 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 115.599 -0.728 . . . . 2.91 111.205 -179.766 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' A' ' 105' ' ' GLN . 5.3 p-80 . . . . . 0 N--CA 1.456 -0.156 0 N-CA-C 109.91 -0.404 . . . . 1.3 109.91 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.7 m -64.97 -10.21 27.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.9 -0.591 . . . . 1.58 110.48 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.36 -51.46 7.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.917 -0.583 . . . . 0.33 110.193 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.585 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -72.13 -34.23 49.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.58 -0.736 . . . . 0.21 109.709 178.775 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' A' ' 105' ' ' GLN . 2.2 tm? -64.87 -53.29 49.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.205 -0.907 . . . . 0.24 110.325 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.45 -45.36 91.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.863 -0.608 . . . . 2.32 111.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.0 74.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.29 111.288 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.556 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -75.88 -30.4 57.72 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.097 -1.049 . . . . 0.4 112.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -64.21 -40.3 95.78 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.36 -0.978 . . . . 0.83 108.36 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.2 m-80 -65.38 -39.23 91.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.626 -1.17 . . . . 0.53 109.918 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.779 HD23 ' CB ' ' A' ' 42' ' ' SER . 3.0 tm? -65.55 -49.82 67.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.312 -0.858 . . . . 1.41 110.824 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -56.52 -32.8 65.44 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.28 -1.007 . . . . 0.75 108.28 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 35.0 t -65.04 -50.28 66.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.99 -1.005 . . . . 1.13 110.773 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.448 ' HB3' HG23 ' A' ' 34' ' ' ILE . 12.1 m-85 -63.11 -42.94 99.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.525 -0.47 . . . . 0.28 111.456 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -50.61 73.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.346 -0.388 . . . . 0.9 110.591 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 72' ' ' SER . 0.4 OUTLIER -55.56 -36.68 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.981 -0.554 . . . . 0.43 112.384 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.2 t -88.28 -9.89 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.098 0.475 . . . . 0.9 110.502 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.457 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -90.14 -27.97 19.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.629 -0.714 . . . . 0.25 111.295 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.2 m -69.24 -10.76 13.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.32 . . . . 0.98 111.422 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.96 -2.43 18.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.126 0.489 . . . . 1.31 110.021 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.4 t -111.61 -0.43 16.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.79 -0.641 . . . . 1.49 111.291 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.778 HG23 HD22 ' A' ' 86' ' ' ASN . 3.8 mm -54.99 103.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 109.839 -0.43 . . . . 1.39 109.839 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.607 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -72.17 -40.56 67.86 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.132 0.491 . . . . 2.55 109.786 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.607 ' N ' ' HG3' ' A' ' 82' ' ' GLN . 0.9 OUTLIER -58.99 178.54 0.11 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.487 -0.779 . . . . 2.56 109.401 179.297 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -136.39 -40.79 0.64 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.464 -0.494 . . . . 2.71 112.147 -178.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -88.88 33.09 0.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.349 0.595 . . . . 2.78 109.445 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.778 HD22 HG23 ' A' ' 81' ' ' ILE . 11.3 p-10 -133.9 -33.68 1.04 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.237 -0.892 . . . . 2.49 111.035 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 20.6 tptp -37.88 -55.22 1.22 Allowed 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.814 -0.63 . . . . 2.28 111.66 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.572 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 97.3 m-85 -56.05 -48.15 76.55 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.056 -0.52 . . . . 2.49 110.901 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.43 -66.29 0.42 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.83 0.347 . . . . 0.35 111.615 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.63 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.9 t80 -65.23 -49.1 70.97 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.995 0.739 . . . . 0.28 112.995 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.616 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 12.2 ttt180 -54.77 -64.1 0.94 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.061 0.393 . . . . 3.34 112.061 -176.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -51.6 -37.43 49.89 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.524 -0.547 . . . . 2.58 109.524 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -56.92 -41.01 77.41 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.732 -0.667 . . . . 0.29 109.531 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.63 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -61.85 -39.12 82.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 108.951 -0.759 . . . . 0.24 108.951 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 0.1 OUTLIER -60.4 -32.06 70.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.607 -1.179 . . . . 0.33 109.695 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 10.6 mptt -62.57 -49.21 76.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.688 -0.486 . . . . 1.64 109.688 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.675 ' CD2' HD12 ' A' ' 70' ' ' LEU . 27.7 tp -59.06 -34.24 71.72 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.634 -0.426 . . . . 0.62 110.135 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 8.0 tp10 -55.42 -57.66 10.96 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.031 -0.531 . . . . 1.87 110.185 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 45.6 m-80 -63.92 -40.02 95.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 2.12 111.123 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.579 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -51.05 -48.65 61.49 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.26 109.999 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.579 ' HG ' HD22 ' A' ' 100' ' ' ASN . 5.6 mt -67.25 -38.5 85.27 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.261 -0.644 . . . . 0.58 109.261 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.505 ' O ' ' OE1' ' A' ' 105' ' ' GLN . 64.7 mtp180 -54.92 -37.59 66.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.275 -0.875 . . . . 2.09 111.473 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -90.59 -15.49 30.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.244 -0.434 . . . . 2.32 111.616 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.565 HD11 ' CE2' ' A' ' 121' ' ' PHE . 6.3 tp -87.3 -22.15 25.32 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.167 1.173 . . . . 0.31 114.167 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.553 ' HA ' ' HG ' ' A' ' 64' ' ' LEU . 1.4 pm0 . . . . . 0 N--CA 1.467 0.378 0 C-N-CA 120.776 -0.37 . . . . 2.04 111.795 -178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.565 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.1 m-30 . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.536 0.208 . . . . 0.47 111.233 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m -77.82 -14.28 59.62 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.855 -0.338 . . . . 1.26 110.449 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.454 ' HB2' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.8 -42.57 63.75 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.007 -0.738 . . . . 2.58 109.007 179.007 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.485 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.25 -23.73 67.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.538 -0.912 . . . . 0.26 108.538 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.9 -48.47 30.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.858 -1.064 . . . . 1.3 110.089 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.7 t -63.05 -34.53 77.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.022 -0.535 . . . . 1.4 110.881 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 70.4 m -63.21 -48.64 77.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.968 -0.56 . . . . 1.09 111.502 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.476 HG13 ' HB ' ' A' ' 43' ' ' THR . 64.8 t -58.53 -52.89 54.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.864 0.364 . . . . 0.51 111.295 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -50.8 -42.26 57.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 2.69 111.271 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.6 tt0 -58.1 -56.11 26.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 2.1 112.265 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.575 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.89 -55.7 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 120.946 0.403 . . . . 0.29 111.111 -178.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 40.0 t -54.03 -47.68 71.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.04 -0.527 . . . . 1.02 110.407 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.51 -20.28 19.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.37 111.858 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.426 HG21 ' N ' ' A' ' 90' ' ' PHE . 89.9 mt -89.15 -30.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.731 0.641 . . . . 0.26 112.731 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.623 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -83.05 -50.94 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 114.665 1.358 . . . . 0.25 114.665 -177.946 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 . . . . . 0 C--N 1.326 -0.44 0 N-CA-C 113.338 0.866 . . . . 0.91 113.338 -176.841 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.459 HG23 ' HB3' ' A' ' 73' ' ' PHE . 48.8 mm . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 121.186 0.517 . . . . 0.39 111.91 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 p -127.64 -178.25 4.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.576 -0.738 . . . . 0.36 109.296 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.621 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -62.52 -37.71 87.1 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.2 -0.6 . . . . 0.99 110.014 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.52 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -57.75 -46.75 91.91 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.635 -0.793 . . . . 0.15 111.147 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.6 t -65.42 -38.48 82.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.508 0.671 . . . . 1.28 109.525 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.39 95.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 114.806 -1.088 . . . . 0.17 110.374 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.458 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 19.1 mt -60.92 -48.33 82.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.203 -0.453 . . . . 0.21 110.466 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.3 -28.85 63.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.079 0.466 . . . . 0.24 110.273 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.809 ' HB2' HD23 ' A' ' 70' ' ' LEU . 58.0 m -78.87 -35.48 43.68 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.705 -0.679 . . . . 0.34 110.926 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.499 HG23 HD21 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -73.69 -26.97 60.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.208 0.528 . . . . 0.42 109.909 178.464 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -80.93 -50.03 10.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.532 -0.758 . . . . 1.52 109.922 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.3 -46.71 36.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.005 -0.543 . . . . 0.28 110.838 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.636 HD22 ' HA2' ' A' ' 67' ' ' GLY . 4.2 pp -69.87 -41.81 74.32 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.879 -0.415 . . . . 0.3 109.879 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.1 t -53.82 -45.59 70.86 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.222 -0.444 . . . . 0.23 110.949 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.98 -42.86 99.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.2 110.185 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.46 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . . . -55.14 -30.29 59.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.204 -0.453 . . . . 0.28 110.166 178.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.606 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.2 mt -74.64 -39.17 46.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.289 -0.634 . . . . 0.21 109.289 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.2 t -77.18 -10.22 59.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.232 -0.895 . . . . 0.45 109.951 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.46 ' HE ' ' HA ' ' A' ' 49' ' ' ALA . 69.4 mtm180 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.591 -0.731 . . . . 2.91 110.832 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.4 p80 . . . . . 0 C--O 1.23 0.069 0 N-CA-C 109.406 -0.59 . . . . 1.3 109.406 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.7 t -76.65 -11.59 59.88 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.397 -0.82 . . . . 1.58 110.752 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -48.61 13.51 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.814 -0.439 . . . . 0.33 109.814 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.518 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -69.87 -36.29 68.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.136 -0.69 . . . . 0.21 109.136 178.465 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.59 HD23 ' HB3' ' A' ' 104' ' ' LEU . 2.4 tm? -61.89 -57.8 10.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.91 -1.041 . . . . 0.24 110.72 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.34 -42.67 99.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.895 -0.593 . . . . 2.32 111.837 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.54 -32.06 72.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.29 110.968 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.636 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -78.49 -29.68 51.91 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.178 -1.011 . . . . 0.4 112.117 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.66 -46.31 83.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 107.997 -1.112 . . . . 0.83 107.997 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -59.85 -42.12 92.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.475 -1.239 . . . . 0.53 110.015 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.809 HD23 ' HB2' ' A' ' 42' ' ' SER . 2.4 tm? -62.57 -49.12 76.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.335 -0.848 . . . . 1.41 110.686 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.545 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . 1.4 t80 -59.02 -36.13 74.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.724 -0.671 . . . . 0.75 109.938 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 9.0 p -74.19 -24.81 59.41 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.877 -0.601 . . . . 1.13 112.559 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.459 ' HB3' HG23 ' A' ' 34' ' ' ILE . 17.8 m-85 -78.78 -44.4 23.32 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 119.544 -0.862 . . . . 0.28 109.377 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.562 ' SG ' HG23 ' A' ' 94' ' ' ILE . 13.0 p -66.99 -21.72 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.37 -0.832 . . . . 0.9 109.534 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.412 HG12 ' N ' ' A' ' 76' ' ' SER . 0.6 OUTLIER -72.45 -43.93 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.43 110.09 179.001 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.412 ' N ' HG12 ' A' ' 75' ' ' VAL . 53.9 m -85.51 -2.5 58.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.9 110.253 178.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.442 ' HB3' ' O ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -99.26 -30.24 12.36 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.64 -0.709 . . . . 0.25 111.806 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.479 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.4 m -63.63 -2.86 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.121 0.415 . . . . 0.98 112.121 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -77.6 8.04 4.86 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.27 -0.423 . . . . 1.31 110.474 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.3 p -119.55 -10.45 9.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.032 -0.531 . . . . 1.49 110.884 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.533 HG21 ' HB2' ' A' ' 87' ' ' LYS . 35.6 mm -50.31 131.37 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 116.354 -0.385 . . . . 1.39 110.897 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.674 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.1 OUTLIER -111.8 -31.19 7.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 116.407 -0.36 . . . . 2.55 111.692 -178.989 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.467 ' HB3' ' HB2' ' A' ' 86' ' ' ASN . 4.0 mt-30 -43.99 -43.03 6.38 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.175 0.805 . . . . 2.56 113.175 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.674 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 23.7 mmt 80.73 -92.89 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.701 0.63 . . . . 2.71 112.701 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -57.82 -9.88 1.46 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.003 0.43 . . . . 2.78 111.077 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.467 ' HB2' ' HB3' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -107.95 -19.3 13.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.763 -0.653 . . . . 2.49 110.18 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.643 ' HD2' ' HA ' ' A' ' 84' ' ' MET . 0.0 OUTLIER -52.32 -38.74 59.36 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.324 0.583 . . . . 2.28 109.463 179.036 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.583 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 84.2 m-85 -57.41 -42.83 83.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.796 -1.093 . . . . 2.49 109.992 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.01 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.35 111.224 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.616 ' CE2' HD11 ' A' ' 94' ' ' ILE . 78.3 t80 -70.32 -45.59 65.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.31 -0.404 . . . . 0.28 111.917 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.671 ' HA ' HD12 ' A' ' 94' ' ' ILE . 9.4 ttp180 -56.73 -63.42 1.21 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.385 -0.37 . . . . 3.34 111.482 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -54.15 -34.8 61.28 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.325 -0.62 . . . . 2.58 109.325 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -57.45 -40.15 77.83 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.884 -0.784 . . . . 0.29 108.884 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.671 HD12 ' HA ' ' A' ' 91' ' ' ARG . 61.0 mt -60.48 -38.79 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 CA-C-N 115.139 -0.937 . . . . 0.24 109.085 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.4 -34.31 77.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.487 -1.233 . . . . 0.33 109.725 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 12.1 mptt -59.21 -45.26 91.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.657 -0.497 . . . . 1.64 109.657 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.711 ' CD2' HD12 ' A' ' 70' ' ' LEU . 28.7 tp -64.52 -31.77 73.12 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 116.339 -0.392 . . . . 0.62 110.305 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.1 -51.2 70.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.217 -0.447 . . . . 1.87 110.191 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 40.2 m-80 -72.65 -37.87 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.023 -0.535 . . . . 2.12 111.016 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.573 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -50.27 -45.54 54.44 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.499 -0.556 . . . . 0.26 109.499 178.863 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.573 ' HG ' HD22 ' A' ' 100' ' ' ASN . 7.5 mt -66.82 -38.86 87.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.364 -0.835 . . . . 0.58 109.14 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 48.6 mtt-85 -57.6 -35.12 70.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.427 -0.806 . . . . 2.09 111.214 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -88.02 -18.47 28.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.169 0.509 . . . . 2.32 109.845 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.59 ' HB3' HD23 ' A' ' 64' ' ' LEU . 14.9 tp -81.1 -34.67 32.46 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 114.092 1.145 . . . . 0.31 114.092 -178.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.424 ' OE1' ' O ' ' A' ' 102' ' ' ARG . 1.2 pm0 . . . . . 0 C--N 1.325 -0.495 0 C-N-CA 120.103 -0.639 . . . . 2.04 110.457 -177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.474 ' CD2' HD11 ' A' ' 104' ' ' LEU . 2.7 m-30 . . . . . 0 N--CA 1.453 -0.323 0 N-CA-C 111.644 0.239 . . . . 0.47 111.644 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 93.6 p -83.08 -25.57 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.709 -0.478 . . . . 1.26 109.709 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -67.17 -31.07 71.23 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.32 -0.993 . . . . 2.58 108.32 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.484 HD12 ' O ' ' A' ' 124' ' ' LEU . 2.2 tp -70.11 -22.95 62.97 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.155 -0.929 . . . . 0.26 108.55 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.82 -49.67 19.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.066 -0.97 . . . . 1.3 110.069 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 m -67.12 -30.1 70.02 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.93 -0.577 . . . . 1.4 110.486 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.5 m -65.56 -44.76 85.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.831 -0.622 . . . . 1.09 111.11 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 43' ' ' THR . 41.7 t -61.64 -53.8 43.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.51 111.32 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -51.87 -39.14 58.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.208 -0.451 . . . . 2.69 111.118 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' HG13 ' A' ' 134' ' ' ILE . 0.9 OUTLIER -61.03 -50.8 71.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 2.1 112.311 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.562 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.0 OUTLIER -55.18 -55.48 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.78 0.324 . . . . 0.29 111.053 -178.826 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.1 t -53.48 -45.56 69.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 1.02 111.131 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.71 -34.0 50.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.004 0.372 . . . . 0.37 112.004 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 130' ' ' GLU . 52.6 mt -74.42 -51.23 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.661 0.615 . . . . 0.26 112.661 -179.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.621 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -56.79 -35.51 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 112.517 0.562 . . . . 0.25 112.517 -178.752 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 . . . . . 0 C--N 1.318 -0.766 0 C-N-CA 120.701 -0.4 . . . . 0.91 110.307 -179.973 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.5 mm . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 121.091 0.472 . . . . 0.39 110.726 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.5 p -129.22 -175.27 3.51 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.734 . . . . 0.36 109.347 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.636 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -63.41 -30.99 72.02 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.203 -0.666 . . . . 0.99 109.203 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.441 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.52 -47.81 79.98 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.134 -0.787 . . . . 0.15 111.134 178.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 52.2 t -63.91 -40.3 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 CA-C-O 121.682 0.753 . . . . 1.28 109.25 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -39.84 86.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.339 -1.3 . . . . 0.17 110.8 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.419 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 20.5 mt -65.81 -49.24 68.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.434 -0.348 . . . . 0.21 110.422 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -54.38 -33.51 59.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.59 -0.522 . . . . 0.24 109.59 178.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m -70.97 -41.72 70.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.561 -0.745 . . . . 0.34 110.789 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.684 HG23 HD11 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -63.75 -33.2 75.13 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.948 0.404 . . . . 0.42 110.703 179.374 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -72.74 -55.05 7.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 1.52 111.367 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.11 -47.51 23.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.28 111.296 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.759 HD21 HD22 ' A' ' 70' ' ' LEU . 4.1 pp -71.08 -38.88 72.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.3 110.08 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.438 ' N ' HD12 ' A' ' 46' ' ' LEU . 34.6 t -53.89 -52.27 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 0.23 110.416 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mp -60.2 -35.03 74.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.033 -0.53 . . . . 1.2 110.003 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -60.23 -35.58 75.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.28 109.75 178.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.0 mt -69.56 -40.2 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 N-CA-C 109.027 -0.731 . . . . 0.21 109.027 178.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.9 t -75.02 -9.38 58.48 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.022 -0.99 . . . . 0.45 109.98 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 115.543 -0.753 . . . . 2.91 110.793 -179.985 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 t-80 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.761 0.315 . . . . 1.3 110.866 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.2 p -97.12 -33.79 11.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.978 0.418 . . . . 1.58 110.713 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.49 -55.06 4.93 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.491 0.923 . . . . 0.33 113.491 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.548 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -64.85 -32.23 57.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 120.716 -0.394 . . . . 0.21 110.834 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -70.76 -58.4 3.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.453 -0.339 . . . . 0.24 111.192 178.623 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -58.59 -44.67 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.385 0.612 . . . . 2.32 110.343 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.89 -26.51 63.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.343 -0.984 . . . . 0.29 108.343 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.89 -46.64 91.08 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 114.835 -1.075 . . . . 0.4 112.488 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -64.99 -42.91 94.1 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.881 0.372 . . . . 0.83 110.826 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -58.09 -39.04 77.59 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.924 -0.58 . . . . 0.53 110.777 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.759 HD22 HD21 ' A' ' 46' ' ' LEU . 10.6 tp -66.63 -50.58 62.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 1.41 111.337 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.46 ' CD1' ' HB2' ' A' ' 98' ' ' GLU . 15.1 t80 -54.76 -35.75 64.11 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.083 -0.71 . . . . 0.75 109.083 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 t -67.14 -41.96 85.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.999 -1.0 . . . . 1.13 111.848 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.4 -43.31 81.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 119.918 -0.713 . . . . 0.28 110.47 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.483 ' HG ' ' HZ ' ' A' ' 90' ' ' PHE . 1.1 m -62.79 -22.89 66.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.9 109.972 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.432 HG12 ' N ' ' A' ' 76' ' ' SER . 1.2 t -75.17 -45.72 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.576 -0.738 . . . . 0.43 111.03 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.432 ' N ' HG12 ' A' ' 75' ' ' VAL . 49.1 m -83.87 -3.32 57.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 0.9 110.665 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -96.38 -32.21 12.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.811 -0.631 . . . . 0.25 111.326 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.4 m -67.86 -6.06 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.048 0.451 . . . . 0.98 111.674 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -79.6 8.46 6.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.119 -0.491 . . . . 1.31 110.084 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 t -127.64 -5.16 5.84 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.853 -0.612 . . . . 1.49 111.054 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.68 HG13 ' HG3' ' A' ' 87' ' ' LYS . 28.9 mm -31.75 -66.02 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.079 0 N-CA-C 112.417 0.525 . . . . 1.39 112.417 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.563 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 77.49 -43.88 0.42 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.263 0.838 . . . . 2.55 113.263 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.591 ' HB3' ' OD1' ' A' ' 86' ' ' ASN . 5.4 mt-30 -50.33 -26.39 4.8 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.039 0.755 . . . . 2.56 113.039 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.5 ' C ' ' H ' ' A' ' 86' ' ' ASN . 27.6 mtm 74.47 -86.87 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.973 1.101 . . . . 2.71 113.973 177.579 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.403 ' H ' ' HB2' ' A' ' 84' ' ' MET . 15.4 ptm180 -64.75 6.36 0.23 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.963 0.411 . . . . 2.78 111.722 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.591 ' OD1' ' HB3' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -119.39 -12.51 9.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.528 0.68 . . . . 2.49 109.407 -179.794 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.68 ' HG3' HG13 ' A' ' 81' ' ' ILE . 2.2 ttpp -57.8 -47.45 82.54 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.752 -1.113 . . . . 2.28 110.751 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -55.82 -46.17 78.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.484 -0.78 . . . . 2.49 110.75 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 92' ' ' GLU . . . -47.55 -70.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.412 0.523 . . . . 0.35 112.412 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.588 ' CE1' HG22 ' A' ' 131' ' ' ILE . 63.7 t80 -62.47 -43.62 98.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.364 0.505 . . . . 0.28 112.364 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.591 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 8.2 ttp180 -56.02 -62.14 1.91 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.617 -0.265 . . . . 3.34 111.423 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -52.96 -33.1 49.51 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.522 -0.308 . . . . 2.58 110.549 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -59.63 -39.94 85.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.478 0.656 . . . . 0.29 109.703 178.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 90' ' ' PHE . 6.3 mt -64.25 -34.31 68.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.351 -0.84 . . . . 0.24 109.471 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -36.09 82.59 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.882 -1.054 . . . . 0.33 109.308 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.65 -47.63 84.87 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.213 -0.662 . . . . 1.64 109.213 178.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.711 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.74 -39.75 85.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.512 -0.767 . . . . 0.62 109.832 178.452 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.46 ' HB2' ' CD1' ' A' ' 71' ' ' TYR . 8.6 tp10 -57.38 -58.01 10.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.466 -0.788 . . . . 1.87 111.029 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.53 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 52.9 m-80 -61.79 -31.68 71.91 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.717 -0.475 . . . . 2.12 109.717 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.629 ' OD1' HD23 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -63.14 -38.47 91.32 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.699 -0.852 . . . . 0.26 108.699 178.261 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.711 HD21 ' CD1' ' A' ' 97' ' ' LEU . 8.9 mt -67.39 -41.7 84.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.159 -1.052 . . . . 0.58 108.159 177.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.53 ' HD3' ' HA ' ' A' ' 99' ' ' ASN . 71.3 mtp180 -56.27 -38.59 71.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.242 -1.344 . . . . 2.09 111.549 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -89.45 -17.77 28.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.035 -0.529 . . . . 2.32 111.743 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.43 HD11 ' CD2' ' A' ' 121' ' ' PHE . 16.5 tp -86.13 -25.31 25.83 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.935 1.087 . . . . 0.31 113.935 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.473 ' OE1' ' O ' ' A' ' 102' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 120.554 -0.458 . . . . 2.04 110.451 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.467 ' HB2' HG21 ' A' ' 50' ' ' ILE . 1.4 m-30 . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.48 0.181 . . . . 0.47 111.448 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.4 m -67.06 -21.54 65.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 1.26 110.363 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.426 ' HB2' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -65.67 -42.14 91.67 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.348 -0.612 . . . . 2.58 109.348 178.864 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.489 HD12 ' O ' ' A' ' 124' ' ' LEU . 2.4 tp -60.79 -26.51 67.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.858 -0.793 . . . . 0.26 108.858 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 tp -70.25 -49.07 53.71 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.232 -0.895 . . . . 1.3 109.933 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -63.19 -36.15 82.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.886 -0.597 . . . . 1.4 110.482 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 131' ' ' ILE . 74.0 m -59.72 -42.56 93.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.833 -0.622 . . . . 1.09 110.729 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 41.8 t -60.32 -53.11 53.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.053 -0.521 . . . . 0.51 111.019 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -50.67 -43.32 57.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 2.69 111.33 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.81 -56.35 22.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 2.1 112.209 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.588 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.34 -55.7 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 121.018 -0.273 . . . . 0.29 111.179 -178.862 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 56.7 p -55.25 -46.26 76.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.94 0.4 . . . . 1.02 110.405 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -53.51 -21.82 7.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.089 -0.505 . . . . 0.37 111.89 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 70.1 mt -88.34 -48.39 14.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.643 0.609 . . . . 0.26 112.643 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.636 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -59.91 -50.34 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 114.371 1.248 . . . . 0.25 114.371 -177.693 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 . . . . . 0 C--N 1.325 -0.489 0 N-CA-C 112.134 0.42 . . . . 0.91 112.134 -177.456 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.656 ' HA ' HG11 ' A' ' 38' ' ' VAL . 40.5 mm . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.21 0.528 . . . . 0.39 112.023 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.49 ' H ' HG12 ' A' ' 38' ' ' VAL . 81.9 p -126.57 -159.57 0.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.441 -0.799 . . . . 0.36 109.614 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.599 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -74.45 -27.76 60.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.718 -0.475 . . . . 0.99 109.718 178.706 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.55 -47.96 82.26 Favored Glycine 0 N--CA 1.453 -0.188 0 CA-C-N 115.642 -0.708 . . . . 0.15 112.021 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.656 HG11 ' HA ' ' A' ' 34' ' ' ILE . 12.4 p -66.68 -37.69 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.518 0.675 . . . . 1.28 109.366 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.438 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.1 t -63.51 -41.48 92.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.622 -1.172 . . . . 0.17 110.962 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.425 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 31.4 mt -65.23 -51.29 61.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.789 0.328 . . . . 0.21 110.285 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.28 -31.41 32.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.152 0.501 . . . . 0.24 109.765 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.3 m -73.14 -42.41 62.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.415 -0.811 . . . . 0.34 111.093 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.667 HG23 HD11 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -63.01 -35.47 80.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.338 . . . . 0.42 111.184 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -72.95 -53.8 10.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 1.52 111.508 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.58 -47.86 28.35 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.348 -0.387 . . . . 0.28 111.69 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.685 HD21 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -70.67 -39.63 73.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.483 -0.326 . . . . 0.3 110.172 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.442 ' N ' HD12 ' A' ' 46' ' ' LEU . 47.2 t -55.25 -37.98 67.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.23 109.93 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.67 -36.25 78.28 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.661 -0.7 . . . . 1.2 109.717 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.74 77.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.605 -0.517 . . . . 0.28 109.605 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.534 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -71.96 -27.37 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 N-CA-C 108.779 -0.823 . . . . 0.21 108.779 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -83.72 -14.82 50.73 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.18 -0.918 . . . . 0.45 109.696 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 115.588 -0.733 . . . . 2.91 111.323 -179.865 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 121.005 0.431 . . . . 1.3 109.989 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -78.34 -9.02 59.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.662 -0.699 . . . . 1.58 110.539 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.67 -45.81 23.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.33 110.403 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.534 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -76.19 -27.9 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.718 -0.673 . . . . 0.21 109.974 179.006 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.464 HD21 ' OE1' ' A' ' 105' ' ' GLN . 2.1 tm? -73.9 -52.45 12.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.35 -0.841 . . . . 0.24 110.793 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -60.23 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.484 0.659 . . . . 2.32 109.463 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.99 -27.9 67.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.064 -0.971 . . . . 0.29 108.419 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.78 -47.31 87.48 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.874 -1.057 . . . . 0.4 112.154 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.527 ' HZ1' ' HB2' ' A' ' 101' ' ' LEU . 0.3 OUTLIER -61.46 -38.14 86.14 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.057 0.456 . . . . 0.83 110.098 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -60.22 -46.03 91.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.658 -0.701 . . . . 0.53 110.5 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.685 HD22 HD21 ' A' ' 46' ' ' LEU . 14.4 tp -57.99 -48.41 80.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.766 -0.652 . . . . 1.41 110.689 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.476 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 23.8 t80 -59.22 -34.98 72.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.201 -0.454 . . . . 0.75 110.059 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 t -76.46 -19.33 58.14 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.85 -0.614 . . . . 1.13 112.009 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -84.71 -44.64 13.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.789 -0.819 . . . . 0.28 108.789 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 4.3 m -69.44 -20.33 63.77 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.643 -0.708 . . . . 0.9 109.09 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.476 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.8 OUTLIER -72.96 -45.37 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-N 115.617 -0.719 . . . . 0.43 110.364 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.423 ' N ' HG12 ' A' ' 75' ' ' VAL . 43.7 t -81.17 -11.06 59.52 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 121.064 0.459 . . . . 0.9 110.357 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.481 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -93.57 -29.19 15.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.668 -0.696 . . . . 0.25 110.407 179.713 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.568 HG21 ' HG2' ' A' ' 91' ' ' ARG . 0.3 OUTLIER -62.1 -30.05 47.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.846 -0.615 . . . . 0.98 111.858 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.87 -4.45 20.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.067 0.461 . . . . 1.31 110.297 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -104.87 7.07 34.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.688 -0.687 . . . . 1.49 111.444 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.602 ' HB ' ' HD2' ' A' ' 87' ' ' LYS . 5.5 mm -70.11 95.92 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.868 0.366 . . . . 1.39 110.952 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.612 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.0 OUTLIER -80.91 -26.04 37.08 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.76 -0.83 . . . . 2.55 108.76 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.681 ' HB3' ' OD1' ' A' ' 86' ' ' ASN . 6.9 mm-40 -37.63 -41.65 0.49 Allowed 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.201 -1.363 . . . . 2.56 113.9 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.612 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 19.1 mmt 82.09 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.856 1.058 . . . . 2.71 113.856 178.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -71.74 29.92 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.976 0.417 . . . . 2.78 111.3 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.681 ' OD1' ' HB3' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -138.8 -23.94 0.93 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.891 -0.595 . . . . 2.49 110.795 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 5.4 mtmt -39.13 -54.52 1.74 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.859 -0.61 . . . . 2.28 111.045 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.405 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 88.5 m-85 -55.34 -48.94 73.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.534 -0.757 . . . . 2.49 111.453 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.435 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -47.03 -69.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.909 0.337 . . . . 0.35 111.909 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.592 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 t80 -60.05 -44.55 94.61 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.184 0.438 . . . . 0.28 112.184 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.626 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -55.1 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.585 0.231 . . . . 3.34 111.387 -178.337 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 12.1 pt-20 -50.82 -36.74 38.88 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.333 -0.394 . . . . 2.58 110.235 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -59.11 -39.63 82.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.125 0.488 . . . . 0.29 109.822 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 90' ' ' PHE . 9.1 mt -62.97 -38.97 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.24 109.396 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASN . . . . . 0.481 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 0.1 OUTLIER -57.57 -43.62 84.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.834 -1.075 . . . . 0.33 110.045 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -50.36 71.86 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.336 -0.393 . . . . 1.64 110.264 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.785 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -54.93 -41.62 71.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.816 -0.629 . . . . 0.62 109.804 178.76 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 95' ' ' ASN . 7.8 tp10 -57.1 -59.97 4.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.443 -0.799 . . . . 1.87 110.881 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -66.72 -9.33 35.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 2.12 110.227 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.557 ' OD1' HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -85.13 -37.73 19.89 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.516 -1.29 . . . . 0.26 107.516 178.773 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.785 HD21 ' CD1' ' A' ' 97' ' ' LEU . 7.6 mt -67.75 -39.88 84.16 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.416 -1.327 . . . . 0.58 107.416 177.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.612 ' O ' ' HB2' ' A' ' 105' ' ' GLN . 75.1 mtt180 -55.9 -53.52 55.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.293 -1.321 . . . . 2.09 110.686 178.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -68.93 -23.89 64.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.709 -0.478 . . . . 2.32 109.709 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.402 HD23 HD23 ' A' ' 64' ' ' LEU . 38.6 tp -76.13 -17.54 59.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.621 -0.718 . . . . 0.31 110.339 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.612 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 115.68 -0.691 . . . . 2.04 110.398 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.483 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 112.176 0.436 . . . . 0.47 112.176 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 88.6 p -75.68 -16.7 60.14 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.737 -0.468 . . . . 1.26 109.737 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.433 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 3.4 mppt? -69.9 -41.91 74.08 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.049 -0.722 . . . . 2.58 109.049 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.557 HD13 ' OD1' ' A' ' 100' ' ' ASN . 1.3 tp -61.63 -25.31 67.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.575 -0.898 . . . . 0.26 108.575 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.29 -48.7 49.1 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.007 -0.997 . . . . 1.3 109.925 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 50.7 m -63.43 -35.75 81.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.754 -0.657 . . . . 1.4 110.51 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 131' ' ' ILE . 39.9 t -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 1.09 110.74 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.601 HG22 HG22 ' A' ' 43' ' ' THR . 17.9 t -60.87 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 0.51 111.124 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -54.57 -38.28 66.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.577 -0.738 . . . . 2.69 112.073 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -60.86 -56.17 24.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.474 0.546 . . . . 2.1 112.474 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.592 HG22 ' CE2' ' A' ' 90' ' ' PHE . 1.3 mt -52.68 -54.15 17.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 121.078 0.466 . . . . 0.29 110.811 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.5 t -53.45 -47.91 69.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.762 -0.653 . . . . 1.02 111.18 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.16 -25.81 61.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.37 111.626 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 78.1 mt -73.33 -51.88 23.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.039 0.385 . . . . 0.26 112.039 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.599 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -62.19 -35.94 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.309 0.485 . . . . 0.25 112.309 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 120.981 -0.288 . . . . 0.91 111.231 -179.728 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.788 ' HA ' HG11 ' A' ' 38' ' ' VAL . 37.1 mm . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.25 0.548 . . . . 0.39 111.091 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.609 ' O ' HG12 ' A' ' 38' ' ' VAL . 73.9 p -125.65 -158.98 0.87 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.766 -0.828 . . . . 0.36 108.766 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.564 ' HB2' HG21 ' A' ' 135' ' ' VAL . 6.1 ttpt -66.5 -35.93 81.48 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.91 -0.716 . . . . 0.99 109.141 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.21 -49.37 63.78 Favored Glycine 0 N--CA 1.452 -0.237 0 CA-C-N 114.989 -1.005 . . . . 0.15 113.005 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.788 HG11 ' HA ' ' A' ' 34' ' ' ILE . 9.7 p -65.26 -37.81 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.205 0 CA-C-O 121.467 0.651 . . . . 1.28 109.866 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.486 ' O ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -65.03 -36.31 77.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 114.671 -1.15 . . . . 0.17 111.08 -179.753 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.468 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 26.8 mt -71.13 -51.54 24.41 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.916 -0.314 . . . . 0.21 110.548 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -54.04 -34.18 59.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.24 109.801 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.623 ' CB ' HD23 ' A' ' 70' ' ' LEU . 65.9 m -73.62 -44.16 57.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.401 -0.818 . . . . 0.34 111.179 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.67 HG23 HD21 ' A' ' 70' ' ' LEU . 0.8 OUTLIER -64.25 -31.44 72.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.986 0.422 . . . . 0.42 110.566 178.622 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -72.46 -54.94 7.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.826 -0.625 . . . . 1.52 111.06 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.79 -47.33 20.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.115 -0.493 . . . . 0.28 111.382 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.466 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.1 pp -72.11 -38.83 69.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.827 -0.349 . . . . 0.3 110.355 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.453 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.4 t -55.35 -37.65 67.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.23 110.249 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.96 -38.82 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.923 -0.58 . . . . 1.2 110.0 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.38 -46.3 76.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.717 -0.475 . . . . 0.28 109.717 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.615 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -62.3 -39.74 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.817 -0.809 . . . . 0.21 108.817 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.0 t -61.43 -17.04 52.47 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.585 -0.895 . . . . 0.45 108.585 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.3 mtt180 . . . . . 0 N--CA 1.452 -0.334 0 CA-C-N 114.854 -1.066 . . . . 2.91 110.923 179.581 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 . . . . . 0 CA--C 1.522 -0.118 0 N-CA-C 109.466 -0.568 . . . . 1.3 109.466 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.8 m -70.88 -8.25 51.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.473 -0.785 . . . . 1.58 110.335 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -47.17 15.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.155 0.502 . . . . 0.33 109.996 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.615 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.98 -28.79 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.449 -0.796 . . . . 0.21 109.775 178.832 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.556 HD23 HD23 ' A' ' 104' ' ' LEU . 1.0 OUTLIER -73.86 -51.49 16.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.132 -0.94 . . . . 0.24 111.015 179.002 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.48 -50.72 70.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.242 0.544 . . . . 2.32 109.723 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.74 -26.91 67.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.375 -0.972 . . . . 0.29 108.375 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.452 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -64.14 -46.48 90.97 Favored Glycine 0 N--CA 1.442 -0.906 0 CA-C-N 114.865 -1.061 . . . . 0.4 112.324 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.18 -41.83 99.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.74 0.305 . . . . 0.83 110.687 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . 0.477 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.7 m-80 -58.42 -40.46 82.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.53 110.995 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.67 HD21 HG23 ' A' ' 43' ' ' THR . 2.6 tm? -65.35 -50.47 65.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 1.41 110.865 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.447 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 12.6 t80 -56.44 -29.86 62.15 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.375 -0.972 . . . . 0.75 108.375 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 32.8 t -67.73 -53.35 28.16 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.927 -1.033 . . . . 1.13 111.112 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.03 -43.62 95.18 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.306 -0.558 . . . . 0.28 111.715 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -52.09 67.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.927 0.394 . . . . 0.9 110.904 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.45 -33.92 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.43 112.871 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.5 t -90.92 -13.36 33.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.038 0.447 . . . . 0.9 110.794 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.487 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -88.24 -24.2 23.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.684 -0.689 . . . . 0.25 111.379 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.7 m -69.8 -12.89 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.98 111.374 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -68.59 -5.64 21.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 1.31 110.355 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.8 m -118.36 6.89 11.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.854 -0.612 . . . . 1.49 111.449 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.845 HG23 HD22 ' A' ' 86' ' ' ASN . 1.0 OUTLIER -47.68 -24.95 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.211 0.448 . . . . 1.39 112.211 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.408 ' OE1' ' C ' ' A' ' 82' ' ' GLN . 5.5 tm0? 64.32 -70.38 0.08 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.144 0.497 . . . . 2.55 110.276 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.495 ' HB3' ' OD1' ' A' ' 86' ' ' ASN . 6.7 mm-40 -51.8 173.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.122 -0.945 . . . . 2.56 109.801 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.42 -20.22 0.85 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.46 -0.496 . . . . 2.71 111.418 -178.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -95.34 15.86 18.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.857 -0.794 . . . . 2.78 108.857 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.845 HD22 HG23 ' A' ' 81' ' ' ILE . 12.7 p-10 -128.87 -30.88 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.863 -1.062 . . . . 2.49 110.863 -179.029 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.65 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 11.1 tttm -42.37 -52.23 4.64 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.878 -0.601 . . . . 2.28 111.916 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -55.04 -45.89 75.28 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.846 -0.341 . . . . 2.49 110.827 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -50.58 -71.0 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.914 0.387 . . . . 0.35 111.987 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.583 ' CE1' HG22 ' A' ' 131' ' ' ILE . 71.4 t80 -61.37 -46.02 91.92 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.476 0.547 . . . . 0.28 112.476 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.65 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -56.48 -57.96 10.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.536 0.207 . . . . 3.34 111.235 -178.084 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.7 pt-20 -50.3 -37.64 37.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.4 -0.364 . . . . 2.58 110.165 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.0 -41.66 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.38 0.61 . . . . 0.29 109.569 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.576 HD11 ' CE2' ' A' ' 90' ' ' PHE . 17.8 mt -62.48 -42.97 97.78 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.433 -0.803 . . . . 0.24 109.328 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.7 -38.9 70.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.86 -1.064 . . . . 0.33 109.371 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 1.1 mptm? -57.17 -46.98 82.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.978 -0.556 . . . . 1.64 109.956 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.588 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 33.2 tp -58.96 -36.15 74.34 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 120.956 0.408 . . . . 0.62 110.147 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.7 OUTLIER -57.24 -59.08 5.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.871 -0.604 . . . . 1.87 110.169 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 34.1 m-80 -71.31 -10.06 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.853 -0.612 . . . . 2.12 111.032 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.478 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.47 -47.95 14.75 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 108.58 -0.896 . . . . 0.26 108.58 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 7.5 mt -64.44 -33.86 76.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.393 -0.966 . . . . 0.58 108.393 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 81.4 mtt180 -55.04 -55.68 28.3 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 114.944 -1.025 . . . . 2.09 110.899 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -73.1 -19.69 61.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.022 0.439 . . . . 2.32 110.47 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.556 HD23 HD23 ' A' ' 64' ' ' LEU . 51.6 tp -76.27 -16.94 59.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.769 -0.65 . . . . 0.31 111.286 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.482 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 116.374 -0.376 . . . . 2.04 111.232 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.467 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.027 0.381 . . . . 0.47 112.027 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 80.2 p -69.75 -17.05 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.676 -0.41 . . . . 1.26 110.014 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -48.21 68.13 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.651 -0.87 . . . . 2.58 108.651 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.522 HD12 ' O ' ' A' ' 124' ' ' LEU . 1.5 tp -54.24 -25.76 24.98 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.214 -0.903 . . . . 0.26 109.251 177.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.78 -48.41 54.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.328 -0.851 . . . . 1.3 110.247 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.5 p -66.85 -35.04 79.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.126 -0.488 . . . . 1.4 111.116 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 26.0 t -62.77 -42.53 99.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 1.09 111.302 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 124' ' ' LEU . 42.6 t -63.14 -50.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.113 -0.494 . . . . 0.51 110.852 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -53.19 -37.65 62.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.89 -0.595 . . . . 2.69 110.548 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.415 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.5 tt0 -60.46 -56.43 21.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.712 -0.677 . . . . 2.1 112.32 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.583 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -52.62 -55.74 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.95 0.405 . . . . 0.29 111.187 -178.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 7.5 t -54.13 -45.57 71.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.61 . . . . 1.02 111.353 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.45 -26.06 64.9 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.151 0.426 . . . . 0.37 112.151 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 130' ' ' GLU . 81.3 mt -75.5 -52.51 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 112.041 0.386 . . . . 0.26 112.041 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.564 HG21 ' HB2' ' A' ' 36' ' ' LYS . 1.4 p -59.67 -37.45 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 112.537 0.569 . . . . 0.25 112.537 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 . . . . . 0 C--N 1.322 -0.598 0 C-N-CA 120.75 -0.38 . . . . 0.91 110.711 -179.829 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.659 ' HA ' HG11 ' A' ' 38' ' ' VAL . 44.2 mm . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.265 0.555 . . . . 0.39 112.215 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.518 ' O ' HG12 ' A' ' 38' ' ' VAL . 81.9 p -123.08 -160.46 0.9 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.266 -0.879 . . . . 0.36 109.09 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.666 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.28 -30.52 60.46 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.177 -0.609 . . . . 0.99 109.408 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.83 -47.61 89.61 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.418 -0.81 . . . . 0.15 111.827 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.659 HG11 ' HA ' ' A' ' 34' ' ' ILE . 13.9 p -67.09 -37.97 80.32 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-O 121.455 0.645 . . . . 1.28 109.34 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.442 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.7 t -60.52 -42.79 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 114.747 -1.115 . . . . 0.17 111.17 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.455 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.0 mt -67.11 -51.51 53.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.243 -0.28 . . . . 0.21 110.243 178.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -52.78 -30.94 35.84 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.178 -0.675 . . . . 0.24 109.178 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.503 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 66.2 m -73.16 -52.67 13.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.177 -0.92 . . . . 0.34 110.664 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.66 HG23 HD21 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -55.62 -29.37 59.05 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.88 0.371 . . . . 0.42 110.87 178.429 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -75.07 -51.86 12.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.102 -0.499 . . . . 1.52 110.661 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.23 -46.78 35.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.97 -0.559 . . . . 0.28 110.992 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 50' ' ' ILE . 3.9 pp -72.71 -40.66 65.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.325 -0.398 . . . . 0.3 110.173 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.458 ' N ' HD12 ' A' ' 46' ' ' LEU . 44.0 t -54.15 -36.21 63.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.089 0.471 . . . . 0.23 110.001 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.78 -34.49 64.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 1.2 109.793 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.02 -36.13 76.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.487 -0.56 . . . . 0.28 109.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.545 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -72.81 -32.3 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 N-CA-C 108.496 -0.927 . . . . 0.21 108.496 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -76.97 -15.29 59.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.118 -0.946 . . . . 0.45 109.389 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 115.512 -0.767 . . . . 2.91 110.934 -179.964 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.094 0.473 . . . . 1.3 109.744 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 48.2 t -78.8 -10.94 59.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.66 -0.7 . . . . 1.58 110.325 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.25 -46.18 23.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.582 . . . . 0.33 110.341 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.545 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -71.29 -25.71 25.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.21 109.235 178.534 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.544 HD21 ' OE1' ' A' ' 105' ' ' GLN . 1.7 tm? -75.63 -48.5 21.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.879 -1.055 . . . . 0.24 110.425 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -61.35 -52.23 65.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.609 0.718 . . . . 2.32 109.272 179.017 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.04 -26.84 67.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.588 -1.187 . . . . 0.29 108.448 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.86 -49.21 69.59 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.06 -0.973 . . . . 0.4 112.478 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HZ1' ' HB2' ' A' ' 101' ' ' LEU . 1.0 OUTLIER -60.72 -43.72 97.52 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.864 0.364 . . . . 0.83 110.399 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 73' ' ' PHE . 17.6 m-80 -58.39 -42.19 86.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.878 -0.601 . . . . 0.53 110.777 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.66 HD21 HG23 ' A' ' 43' ' ' THR . 1.1 tm? -58.5 -48.66 80.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 1.41 110.223 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.474 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 47.8 t80 -60.62 -33.29 72.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.75 110.914 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.4 p -80.76 -16.77 52.96 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.207 0.447 . . . . 1.13 112.207 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 69' ' ' ASN . 24.3 m-85 -80.28 -44.29 19.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.506 -0.924 . . . . 0.28 108.506 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 78' ' ' VAL . 7.8 m -70.93 -27.4 63.74 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.337 -0.847 . . . . 0.9 109.15 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -64.57 -38.32 82.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-N 115.618 -0.719 . . . . 0.43 110.95 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.8 t -91.27 -11.71 37.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.922 0.392 . . . . 0.9 110.44 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.472 ' HB2' HG22 ' A' ' 34' ' ' ILE . 1.2 t80 -90.7 -26.58 19.48 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.919 -0.582 . . . . 0.25 111.929 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.498 HG11 ' HG2' ' A' ' 91' ' ' ARG . 2.8 m -63.06 -10.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 121.125 0.488 . . . . 0.98 111.044 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.0 6.67 3.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.958 -0.565 . . . . 1.31 110.598 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 41.1 t -126.66 -1.17 6.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.039 -0.528 . . . . 1.49 111.106 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.777 HG23 HD22 ' A' ' 86' ' ' ASN . 18.3 mm -40.74 -30.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 112.444 0.535 . . . . 1.39 112.444 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? 61.57 -72.36 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 123.767 0.667 . . . . 2.55 109.863 -178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.562 ' HB3' ' CG ' ' A' ' 86' ' ' ASN . 1.4 tm0? -49.02 156.5 0.51 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.256 -1.016 . . . . 2.56 108.256 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.4 ptm -122.48 -34.66 3.22 Favored 'General case' 0 C--N 1.314 -0.957 0 C-N-CA 120.019 -0.672 . . . . 2.71 112.723 -177.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -86.02 27.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.315 -0.624 . . . . 2.78 109.315 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.777 HD22 HG23 ' A' ' 81' ' ' ILE . 5.2 p-10 -132.11 -29.47 1.63 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.9 -1.046 . . . . 2.49 110.77 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 7.8 mttt -39.69 -50.19 2.3 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.731 -0.668 . . . . 2.28 111.519 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -56.39 -48.74 76.27 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.238 -0.437 . . . . 2.49 110.455 -179.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.09 -68.37 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.046 0.388 . . . . 0.35 112.046 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.731 ' CE2' HD11 ' A' ' 94' ' ' ILE . 89.5 t80 -66.43 -50.23 64.09 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.429 0.899 . . . . 0.28 113.429 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.625 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -58.55 -47.86 82.81 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.339 -0.144 . . . . 3.34 111.308 -176.73 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 6.5 pt-20 -58.9 -37.88 77.61 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.651 -0.5 . . . . 2.58 109.651 178.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.18 -41.28 88.11 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.172 -0.677 . . . . 0.29 109.172 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.731 HD11 ' CE2' ' A' ' 90' ' ' PHE . 40.4 mt -60.19 -42.75 91.39 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.289 -0.869 . . . . 0.24 109.039 178.397 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASN . . . . . 0.48 ' OD1' ' HD2' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -58.53 -44.79 89.69 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 114.556 -1.202 . . . . 0.33 109.666 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.48 ' HD2' ' OD1' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -48.44 -45.82 36.92 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.093 0.473 . . . . 1.64 109.783 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.802 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -60.63 -40.75 93.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.76 . . . . 0.62 110.055 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -55.29 -61.29 2.43 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.707 -0.679 . . . . 1.87 111.627 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.442 ' ND2' ' O ' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -60.42 -35.44 75.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.907 -0.405 . . . . 2.12 109.907 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.56 ' OD1' HD23 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -58.93 -34.58 71.9 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.895 -0.779 . . . . 0.26 108.895 177.434 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.802 HD21 ' CD1' ' A' ' 97' ' ' LEU . 10.9 mt -71.06 -41.65 70.45 Favored 'General case' 0 C--N 1.34 0.171 0 N-CA-C 108.307 -0.997 . . . . 0.58 108.307 177.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 90.8 mtt180 -54.21 -47.85 71.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.693 -1.14 . . . . 2.09 111.478 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -79.01 -23.99 43.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.862 0.363 . . . . 2.32 110.66 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.3 tp -73.66 -15.8 61.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.31 111.334 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.544 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.52 -0.175 0 CA-C-N 116.386 -0.37 . . . . 2.04 110.912 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.427 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 1.6 m-30 . . . . . 0 C--O 1.231 0.126 0 N-CA-C 112.021 0.378 . . . . 0.47 112.021 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 89.7 p -67.93 -15.93 63.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 1.26 110.085 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -69.97 -36.65 75.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.13 -0.693 . . . . 2.58 109.13 178.866 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.3 OUTLIER -65.6 -23.81 66.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.441 -0.948 . . . . 0.26 108.441 178.21 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.37 -48.62 32.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.877 -1.056 . . . . 1.3 110.309 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.2 t -66.59 -34.78 78.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.84 -0.618 . . . . 1.4 110.86 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 131' ' ' ILE . 67.5 m -62.44 -45.7 91.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.941 -0.572 . . . . 1.09 111.157 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 124' ' ' LEU . 46.1 t -60.52 -54.86 29.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.51 111.51 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -50.51 -38.94 47.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.96 -0.563 . . . . 2.69 111.39 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.09 -56.02 23.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.971 -0.558 . . . . 2.1 112.46 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.703 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -52.36 -55.31 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.681 0.277 . . . . 0.29 111.13 -178.743 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 54.4 p -53.73 -47.42 70.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 1.02 111.004 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -53.01 -29.58 30.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.38 -0.373 . . . . 0.37 111.752 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.9 mt -79.3 -51.42 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.837 0.68 . . . . 0.26 112.837 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.666 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -57.57 -45.55 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.518 0.562 . . . . 0.25 112.518 -178.709 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 . . . . . 0 C--N 1.321 -0.673 0 CA-C-N 116.465 -0.334 . . . . 0.91 111.737 -178.809 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.855 0.359 . . . . 4.47 110.864 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.45 -112.96 4.58 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.933 -0.651 . . . . 2.5 112.105 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -135.71 12.27 3.43 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.916 0.389 . . . . 2.01 111.043 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.475 HG22 ' HB2' ' A' ' 77' ' ' TYR . 49.6 mm 64.76 98.65 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.624 -0.717 . . . . 0.39 111.918 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.4 p -131.75 -172.44 2.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.36 109.898 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.634 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -66.08 -33.55 76.04 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.541 -0.464 . . . . 0.99 110.073 179.404 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.402 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.78 -45.9 94.77 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 0.15 111.316 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.4 t -67.91 -39.97 82.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.657 0.741 . . . . 1.28 109.525 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -43.28 95.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.619 -1.173 . . . . 0.17 110.852 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.483 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 23.8 mt -60.98 -48.8 80.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.763 0.316 . . . . 0.21 110.543 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.69 -33.25 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.24 110.366 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.808 ' CB ' HD23 ' A' ' 70' ' ' LEU . 46.0 m -76.87 -35.41 57.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.34 111.47 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.483 ' OG1' ' HA ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -71.8 -33.39 68.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.971 0.415 . . . . 0.42 110.838 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -77.22 -48.88 16.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.02 -0.536 . . . . 1.52 110.776 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.93 -46.99 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.139 -0.482 . . . . 0.28 110.974 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.525 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.91 -38.44 79.58 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.306 -0.406 . . . . 0.3 110.247 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.525 ' N ' HD12 ' A' ' 46' ' ' LEU . 7.8 t -55.52 -35.68 65.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.004 0.431 . . . . 0.23 109.847 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.18 -34.21 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.826 -0.624 . . . . 1.2 109.834 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.32 -35.4 73.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.232 -0.655 . . . . 0.28 109.232 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.524 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.5 mt -72.11 -33.71 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.701 -0.852 . . . . 0.21 108.701 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -74.37 -12.82 60.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.041 -0.982 . . . . 0.45 109.6 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.444 ' C ' ' H ' ' A' ' 54' ' ' SER . 13.5 ttm180 -86.22 -20.02 29.12 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.364 -0.834 . . . . 2.91 110.98 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.463 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 5.9 t-20 -71.44 12.13 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 1.88 111.089 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.444 ' H ' ' C ' ' A' ' 52' ' ' ARG . 47.3 t -127.42 -24.97 3.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 2.2 110.274 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -69.18 -27.96 65.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.843 -0.617 . . . . 3.68 111.136 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.08 41.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.122 -0.49 . . . . 4.31 110.804 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.1 mtt 74.74 -37.56 0.36 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.641 -0.709 . . . . 3.85 112.104 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.463 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . . . 50.45 -117.08 1.01 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.84 -0.164 . . . . 1.92 111.225 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 95.2 p -174.47 135.43 0.42 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.739 0.304 . . . . 2.28 110.95 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -67.09 -23.04 65.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.204 -0.453 . . . . 1.3 109.887 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.5 m -76.9 -3.22 37.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.754 -0.657 . . . . 1.58 110.848 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.73 -53.73 5.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.094 0.473 . . . . 0.33 109.891 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.524 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -69.64 -28.97 39.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.21 109.701 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.634 HD21 ' NE2' ' A' ' 105' ' ' GLN . 0.6 OUTLIER -72.23 -53.42 12.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.841 -1.072 . . . . 0.24 110.98 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.37 -49.37 78.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.302 0.572 . . . . 2.32 109.894 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.24 -27.32 67.12 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.368 -0.975 . . . . 0.29 108.368 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.437 ' HA3' HD22 ' A' ' 101' ' ' LEU . . . -61.75 -47.54 89.71 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.746 -1.116 . . . . 0.4 112.582 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.438 ' HD2' HD13 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -65.81 -41.36 91.97 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.574 0.226 . . . . 0.83 111.224 -179.535 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.419 ' O ' ' HB2' ' A' ' 72' ' ' SER . 19.7 m-80 -58.42 -43.16 88.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.91 0.386 . . . . 0.53 110.953 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.808 HD23 ' CB ' ' A' ' 42' ' ' SER . 3.2 tm? -64.7 -50.21 67.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.977 -0.556 . . . . 1.41 111.133 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.41 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 7.2 t80 -56.52 -33.27 65.88 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.679 -0.86 . . . . 0.75 108.679 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 70.6 m -65.17 -50.6 65.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.012 -0.994 . . . . 1.13 111.001 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.455 ' HB3' HG23 ' A' ' 34' ' ' ILE . 11.5 m-85 -62.17 -43.64 98.39 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.363 -0.535 . . . . 0.28 111.639 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -51.19 70.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.263 -0.426 . . . . 0.9 110.896 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.36 -37.79 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 112.527 0.566 . . . . 0.43 112.527 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -86.4 -10.27 54.64 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.056 0.455 . . . . 0.9 110.866 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.475 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -91.91 -23.55 19.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.787 -0.642 . . . . 0.25 111.778 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.0 OUTLIER -72.81 -11.44 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.949 0.404 . . . . 0.98 111.574 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -71.9 -3.61 23.47 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 1.31 109.681 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -110.64 1.97 18.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.45 -0.795 . . . . 1.49 111.459 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.621 HG21 ' HB2' ' A' ' 87' ' ' LYS . 23.3 mm -66.31 115.78 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 120.528 -0.469 . . . . 1.39 110.172 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.551 ' O ' ' HG3' ' A' ' 84' ' ' MET . 0.0 OUTLIER -84.67 -29.11 25.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 121.087 0.47 . . . . 2.55 110.099 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.524 ' HB3' ' OD1' ' A' ' 86' ' ' ASN . 15.0 mm100 -46.52 -47.08 19.55 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.26 -0.882 . . . . 2.56 113.101 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.551 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 43.3 mtm 81.91 -91.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.763 0.653 . . . . 2.71 112.763 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -64.75 0.92 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.886 0.374 . . . . 2.78 111.736 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.524 ' OD1' ' HB3' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -114.61 -17.97 11.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.067 -0.716 . . . . 2.49 109.067 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.621 ' HB2' HG21 ' A' ' 81' ' ' ILE . 0.6 OUTLIER -58.77 -35.65 73.11 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.173 -0.921 . . . . 2.28 109.289 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.463 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 71.1 m-85 -56.98 -44.25 82.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.574 -0.739 . . . . 2.49 110.026 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -53.77 -61.82 2.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 0.35 112.085 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.654 ' CE2' HD11 ' A' ' 94' ' ' ILE . 66.9 t80 -63.23 -45.59 90.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.28 111.559 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.595 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.2 OUTLIER -58.15 -52.44 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 3.34 111.723 -178.139 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 11.0 pt-20 -54.94 -36.46 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.192 -0.299 . . . . 2.58 110.192 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.06 -40.03 88.09 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.665 0.745 . . . . 0.29 109.123 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.654 HD11 ' CE2' ' A' ' 90' ' ' PHE . 32.9 mt -61.81 -41.2 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.174 -0.921 . . . . 0.24 109.018 178.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.51 -39.11 79.18 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.589 -1.187 . . . . 0.33 109.292 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 1.3 mptm? -54.4 -47.5 72.67 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.752 -0.462 . . . . 1.64 109.752 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.724 ' CD2' HD12 ' A' ' 70' ' ' LEU . 33.7 tp -59.95 -32.27 70.64 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.631 -0.427 . . . . 0.62 110.197 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -58.64 -60.14 4.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.144 -0.48 . . . . 1.87 110.736 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.441 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 0.9 OUTLIER -73.57 -10.22 59.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 2.12 111.474 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.492 HD22 HD22 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -76.9 -47.86 19.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.723 -0.843 . . . . 0.26 108.723 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 8.2 mt -66.42 -31.92 72.97 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.234 -0.894 . . . . 0.58 108.659 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.441 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 87.1 mtt180 -54.69 -55.76 26.41 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.092 -0.958 . . . . 2.09 110.764 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -71.89 -18.99 62.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.979 0.418 . . . . 2.32 110.495 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.497 HD11 ' CE2' ' A' ' 121' ' ' PHE . 32.9 tp -79.53 -18.18 52.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.941 -0.572 . . . . 0.31 111.225 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.634 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -52.18 -95.44 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.483 -0.326 . . . . 2.04 111.322 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.465 ' H ' ' HB3' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -145.76 -48.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.45 -0.341 . . . . 1.69 111.359 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.463 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.0 OUTLIER 66.78 154.44 0.13 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.233 -0.44 . . . . 2.44 111.158 179.659 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -47.68 -67.75 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.641 2.227 . . . . 3.01 112.779 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -166.79 1.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.587 -0.279 . . . . 4.42 111.383 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.3 m -53.64 -46.54 70.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 5.41 111.156 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.25 -72.12 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 5.83 111.02 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.88 107.93 0.9 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.849 -0.691 . . . . 5.16 112.322 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 79.2 p -79.1 -10.01 59.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 4.55 111.075 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 152.86 -78.55 0.2 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.771 -0.728 . . . . 4.42 112.877 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.46 -62.73 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.56 2.174 . . . . 5.57 112.582 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.63 121.02 15.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.454 . . . . 3.79 111.31 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -104.46 -56.94 2.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.224 -0.444 . . . . 2.68 110.831 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.6 p 54.47 107.83 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.423 0.63 . . . . 2.42 111.444 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -121.83 83.65 2.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.279 -0.873 . . . . 2.35 111.159 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.5 81.59 1.81 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.496 -0.775 . . . . 2.16 109.72 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.497 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.5 m-30 -85.02 43.1 0.98 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.47 111.733 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.655 ' HB2' ' HZ1' ' A' ' 123' ' ' LYS . 31.0 m -71.64 -14.28 62.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.938 -0.305 . . . . 1.26 110.605 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.655 ' HZ1' ' HB2' ' A' ' 122' ' ' SER . 0.1 OUTLIER -69.64 -44.21 71.06 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.198 -0.668 . . . . 2.58 109.198 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.526 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.1 OUTLIER -59.61 -25.44 64.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.376 -0.829 . . . . 0.26 108.771 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tp -73.88 -48.19 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.134 -0.939 . . . . 1.3 110.636 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.5 t -63.91 -35.82 81.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.131 -0.486 . . . . 1.4 111.123 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 131' ' ' ILE . 65.6 m -65.58 -46.74 78.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.541 . . . . 1.09 111.91 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.45 HG13 ' HB ' ' A' ' 43' ' ' THR . 55.3 t -62.89 -55.43 23.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 0.51 111.537 -178.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -50.61 -40.68 53.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.764 -0.653 . . . . 2.69 111.017 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.5 -55.31 36.64 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.837 -0.62 . . . . 2.1 112.061 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.583 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.24 -56.14 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 120.735 0.303 . . . . 0.29 111.157 -178.857 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 30.7 t -56.61 -47.6 79.27 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.262 -0.426 . . . . 1.02 110.758 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.659 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 17.3 t70 -50.18 -26.73 4.91 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.922 -0.581 . . . . 0.37 112.28 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.1 mt -86.29 -51.21 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 113.131 0.789 . . . . 0.26 113.131 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.634 HG21 ' HG3' ' A' ' 36' ' ' LYS . 1.4 p -53.98 -47.56 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 113.897 1.073 . . . . 0.25 113.897 -177.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLN . . . . . 0.583 ' HB2' ' CZ ' ' A' ' 137' ' ' ARG . 38.5 mt-30 -60.15 -37.82 81.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.636 -0.426 . . . . 0.91 111.709 -178.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.705 ' HE ' ' N ' ' A' ' 137' ' ' ARG . 0.0 OUTLIER -94.51 28.91 2.42 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.628 -0.878 . . . . 4.06 108.628 178.719 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.507 ' HG ' ' HG3' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -132.16 -35.63 1.19 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.278 -1.328 . . . . 1.89 111.082 -178.108 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 139' ' ' GLU . 8.4 pt-20 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.543 -0.742 . . . . 4.17 111.013 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.95 0.405 . . . . 4.47 110.616 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.81 -114.08 4.57 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.007 -0.616 . . . . 2.5 111.903 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.18 18.78 2.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 2.01 110.862 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.69 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.4 mm 64.83 106.69 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.514 -0.766 . . . . 0.39 111.814 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.532 ' O ' HG12 ' A' ' 38' ' ' VAL . 81.2 p -123.45 -160.27 0.9 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.427 -0.806 . . . . 0.36 109.179 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.652 ' HB2' HG21 ' A' ' 135' ' ' VAL . 6.5 ttpt -69.78 -39.97 76.3 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.206 -0.597 . . . . 0.99 109.426 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -52.18 -49.6 49.5 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.251 -0.886 . . . . 0.15 112.861 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.69 HG11 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -65.82 -38.67 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.606 0.717 . . . . 1.28 109.565 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.428 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.3 t -62.64 -38.11 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.578 -1.192 . . . . 0.17 111.181 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.0 mt -68.18 -51.41 46.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.062 -0.347 . . . . 0.21 110.062 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.48 -31.02 21.97 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.315 -0.624 . . . . 0.24 109.315 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.2 m -73.96 -44.33 55.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.301 -0.863 . . . . 0.34 110.7 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.849 HG22 HG22 ' A' ' 128' ' ' VAL . 3.6 p -60.2 -37.7 81.04 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 120.865 0.364 . . . . 0.42 111.049 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.46 -52.91 27.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 1.52 111.29 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.12 -47.11 34.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.28 111.572 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.794 HD21 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -74.91 -40.26 60.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.45 -0.341 . . . . 0.3 110.742 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.437 ' N ' HD12 ' A' ' 46' ' ' LEU . 44.1 t -55.46 -39.96 71.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.048 0.451 . . . . 0.23 110.276 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -70.3 -35.01 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 1.2 109.948 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.04 81.38 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.702 -0.481 . . . . 0.28 109.702 178.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.632 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.0 mt -70.72 -30.18 41.04 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 N-CA-C 108.785 -0.82 . . . . 0.21 108.785 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -79.15 -13.8 59.5 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.117 -0.947 . . . . 0.45 109.649 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.564 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . 47.4 mtp180 -92.62 -15.93 26.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.375 -0.829 . . . . 2.91 111.439 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.469 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 6.6 t-20 -79.44 14.54 1.55 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.88 111.087 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 43.5 t -102.17 -14.25 17.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.251 -0.431 . . . . 2.2 110.973 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 57' ' ' MET . 18.6 mm-40 -102.02 6.8 41.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.381 . . . . 3.68 111.125 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 58.62 29.15 18.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.028 -0.533 . . . . 4.31 111.329 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.41 ' HG3' ' O ' ' A' ' 55' ' ' GLU . 62.8 mtt -124.93 -0.56 7.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.386 -0.37 . . . . 3.85 110.789 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.564 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . . . -102.23 -140.58 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 1.92 111.103 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.6 t -175.73 140.29 0.44 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.376 -0.375 . . . . 2.28 110.726 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -65.51 -18.84 65.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.26 -0.427 . . . . 1.3 109.861 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -78.08 -10.88 59.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.729 -0.669 . . . . 1.58 110.27 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.28 -45.94 24.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.33 110.206 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.632 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.13 -29.55 21.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.21 109.896 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.677 HD23 HD23 ' A' ' 104' ' ' LEU . 1.2 tm? -74.35 -51.24 15.67 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.992 -1.004 . . . . 0.24 111.18 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.31 -49.47 71.62 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.154 0.502 . . . . 2.32 109.799 179.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.96 -27.41 67.44 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.258 -1.015 . . . . 0.29 108.258 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -65.08 -46.42 88.63 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.795 -1.093 . . . . 0.4 112.253 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.497 ' HZ1' HD11 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -61.28 -43.94 98.04 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.847 0.356 . . . . 0.83 110.559 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -58.44 -41.95 86.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.53 111.033 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.794 HD22 HD21 ' A' ' 46' ' ' LEU . 12.9 tp -61.52 -47.69 84.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.2 -0.455 . . . . 1.41 110.432 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.592 ' HB2' HD23 ' A' ' 97' ' ' LEU . 10.5 t80 -57.94 -35.42 71.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.933 -0.576 . . . . 0.75 110.228 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 53.1 p -80.23 -18.62 48.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 1.13 112.399 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -80.31 -44.44 19.55 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.326 -0.99 . . . . 0.28 108.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 77' ' ' TYR . 3.8 m -68.99 -27.08 65.37 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.502 -0.772 . . . . 0.9 109.118 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.475 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.5 OUTLIER -66.14 -37.78 80.51 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.615 -0.721 . . . . 0.43 110.801 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.5 t -91.06 -9.66 44.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.996 0.426 . . . . 0.9 110.07 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.503 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -90.77 -28.35 18.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.634 -0.712 . . . . 0.25 111.454 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.44 ' HA ' HG12 ' A' ' 81' ' ' ILE . 3.4 m -66.1 -11.39 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.96 0.409 . . . . 0.98 111.663 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -71.05 -2.9 17.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 1.31 110.811 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 57.4 p -119.19 3.56 11.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.977 -0.556 . . . . 1.49 111.924 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.473 HG21 ' CA ' ' A' ' 87' ' ' LYS . 11.9 mm -55.22 -33.06 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 111.956 0.354 . . . . 1.39 111.956 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 84' ' ' MET . 5.6 tm0? 61.96 -66.65 0.07 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.565 0.95 . . . . 2.55 113.565 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.515 ' O ' ' N ' ' A' ' 85' ' ' ARG . 34.4 mt-30 -46.03 -9.33 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.97 1.1 . . . . 2.56 113.97 -177.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.546 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 7.5 ptt? 48.43 -69.92 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.566 1.321 . . . . 2.71 114.566 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 83' ' ' GLN . 34.0 ttm180 -48.97 -40.87 32.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.568 0.622 . . . . 2.78 110.729 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.818 HD21 ' HG ' ' A' ' 138' ' ' LEU . 21.1 p-10 -73.3 -28.2 61.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.692 -0.686 . . . . 2.49 110.631 179.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.602 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -56.72 -37.05 70.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.027 -0.533 . . . . 2.28 111.021 -179.336 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -57.03 -48.5 78.35 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.578 -0.449 . . . . 2.49 110.067 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.91 -65.6 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.955 -0.566 . . . . 0.35 111.875 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.594 ' CE1' HG22 ' A' ' 131' ' ' ILE . 68.0 t80 -62.83 -47.4 83.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.535 0.569 . . . . 0.28 112.535 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.602 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.8 OUTLIER -57.99 -56.52 20.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.686 -0.233 . . . . 3.34 111.32 -177.446 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.7 pt-20 -52.38 -36.18 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.886 -0.413 . . . . 2.58 109.886 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -61.45 -38.91 88.92 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.366 -0.605 . . . . 0.29 109.366 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.573 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -62.26 -40.93 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 N-CA-C 108.724 -0.843 . . . . 0.24 108.724 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.402 ' O ' ' ND2' ' A' ' 99' ' ' ASN . 0.1 OUTLIER -58.65 -42.53 88.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.444 -1.253 . . . . 0.33 109.225 179.238 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -52.92 -40.94 63.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.501 -0.555 . . . . 1.64 109.501 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.593 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 15.5 tp -65.3 -35.79 82.07 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.888 -0.596 . . . . 0.62 110.238 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -53.63 -61.37 2.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.076 0.465 . . . . 1.87 110.383 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.463 ' H ' ' ND2' ' A' ' 99' ' ' ASN . 0.4 OUTLIER -63.35 -40.62 97.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.669 -0.696 . . . . 2.12 111.156 179.054 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.537 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -49.45 -45.56 46.8 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.957 0.408 . . . . 0.26 110.051 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 4.8 mt -68.27 -39.55 82.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.792 -0.64 . . . . 0.58 109.537 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 47.0 mtp180 -54.59 -48.48 72.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.237 -0.892 . . . . 2.09 111.307 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.84 -21.35 55.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.087 0.47 . . . . 2.32 110.19 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.677 HD23 HD23 ' A' ' 64' ' ' LEU . 22.2 tp -77.79 -11.92 59.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.632 -0.713 . . . . 0.31 110.916 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.496 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -57.11 -177.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.049 -0.523 . . . . 2.04 111.146 179.837 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.455 HG23 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -63.31 -49.06 84.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 1.69 110.459 -179.933 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.455 ' N ' HG23 ' A' ' 106' ' ' ILE . 9.1 p 25.64 95.72 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.298 0 N-CA-C 113.261 0.837 . . . . 2.44 113.261 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -64.95 -63.12 0.08 OUTLIER 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 123.329 2.686 . . . . 3.01 112.076 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.448 ' HA ' ' HB2' ' A' ' 113' ' ' SER . . . -174.08 9.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.022 -0.536 . . . . 4.42 111.032 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -51.36 -41.49 60.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.006 -0.543 . . . . 5.41 111.269 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.62 -33.22 60.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 5.83 111.244 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 137.92 53.51 0.05 OUTLIER Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.736 -0.745 . . . . 5.16 112.566 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.448 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 49.1 m -109.18 173.63 6.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.901 0.381 . . . . 4.55 111.1 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -153.44 -75.45 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.835 -0.698 . . . . 4.42 112.646 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.36 -65.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.441 2.094 . . . . 5.57 112.4 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 53.61 84.37 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.317 -0.401 . . . . 3.79 111.067 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -149.72 -178.56 6.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 2.68 111.058 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 p 47.79 77.78 0.09 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.943 0.877 . . . . 2.42 110.71 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -80.51 83.9 6.22 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.921 -1.49 . . . . 2.35 111.103 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -119.86 83.67 2.08 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.961 -0.755 . . . . 2.16 108.961 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.436 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.5 OUTLIER -78.46 42.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.727 -0.67 . . . . 0.47 111.871 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 58.7 m -66.45 -15.26 63.2 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.837 -0.345 . . . . 1.26 110.221 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.437 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.41 -40.11 67.42 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.123 -0.695 . . . . 2.58 109.123 178.752 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 124' ' ' LEU . 1.7 tp -65.5 -15.97 63.2 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.895 -0.78 . . . . 0.26 108.895 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.81 -48.18 13.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.173 -0.922 . . . . 1.3 110.15 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.9 p -73.54 -29.36 62.4 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 1.4 110.741 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.0 t -69.32 -49.13 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.883 -0.599 . . . . 1.09 110.691 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.849 HG22 HG22 ' A' ' 43' ' ' THR . 0.3 OUTLIER -61.25 -42.15 92.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 115.372 -0.831 . . . . 0.51 110.832 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -64.35 -33.9 76.9 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.878 -0.601 . . . . 2.69 110.404 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -59.59 -46.53 88.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.761 -0.654 . . . . 2.1 110.751 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.594 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.5 OUTLIER -57.25 -55.65 19.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.923 0.392 . . . . 0.29 110.464 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 135' ' ' VAL . 1.4 t -53.68 -42.74 68.27 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.911 -0.586 . . . . 1.02 110.809 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.77 -37.89 77.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.998 -0.546 . . . . 0.37 112.066 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.507 ' O ' ' HB2' ' A' ' 138' ' ' LEU . 72.8 mt -64.46 -53.1 46.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 112.057 0.392 . . . . 0.26 112.057 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.652 HG21 ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.05 -40.8 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 N-CA-C 112.793 0.664 . . . . 0.25 112.793 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -55.1 -54.61 40.97 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.935 0.346 . . . . 0.91 111.935 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.496 HH21 HG23 ' A' ' 134' ' ' ILE . 0.0 OUTLIER -79.28 -14.65 58.88 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.253 0.549 . . . . 4.06 109.706 179.313 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.818 ' HG ' HD21 ' A' ' 86' ' ' ASN . 0.6 OUTLIER -62.71 -74.57 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.275 -0.875 . . . . 1.89 111.357 -179.818 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.174 -0.917 . . . . 4.17 111.186 -179.841 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.41 ' OG ' HD13 ' A' ' 34' ' ' ILE . 87.2 p . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 121.017 0.437 . . . . 4.47 110.434 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -108.07 80.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.697 -0.683 . . . . 2.5 111.479 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 49.79 21.82 0.73 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.069 0.462 . . . . 2.01 111.523 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.681 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.1 mm 62.66 107.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.379 -0.828 . . . . 0.39 112.152 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.525 ' O ' HG12 ' A' ' 38' ' ' VAL . 72.0 p -124.02 -160.35 0.92 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.319 -0.855 . . . . 0.36 109.342 178.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.626 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -75.5 -27.14 58.67 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.467 -0.568 . . . . 0.99 109.467 178.443 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.64 -46.58 93.43 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.46 -0.791 . . . . 0.15 111.832 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.681 HG11 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -68.88 -36.03 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.688 0.756 . . . . 1.28 109.29 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.403 HG22 ' SG ' ' A' ' 74' ' ' CYS . 1.5 t -63.26 -43.66 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.467 -1.242 . . . . 0.17 110.764 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.498 HD12 ' HE3' ' A' ' 36' ' ' LYS . 26.4 mt -61.73 -51.12 69.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.798 0.332 . . . . 0.21 110.254 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -54.64 -30.09 54.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.24 110.166 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.793 ' HB2' HD23 ' A' ' 70' ' ' LEU . 70.2 m -79.38 -36.79 38.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.624 -0.716 . . . . 0.34 111.456 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.568 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -71.33 -26.93 63.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.177 0.513 . . . . 0.42 109.802 178.698 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -80.85 -45.74 16.39 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.592 -0.731 . . . . 1.52 109.956 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.91 -47.26 52.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.928 -0.578 . . . . 0.28 111.043 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.565 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -72.66 -39.28 67.25 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.726 -0.39 . . . . 0.3 110.056 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.565 ' N ' HD12 ' A' ' 46' ' ' LEU . 51.9 t -54.2 -42.25 69.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.128 -0.487 . . . . 0.23 110.276 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -38.4 81.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.77 -0.65 . . . . 1.2 109.682 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . -57.25 -28.97 63.42 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.28 109.803 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -75.88 -39.37 37.78 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 108.888 -0.782 . . . . 0.21 108.888 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t -73.13 -10.04 59.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.273 -0.876 . . . . 0.45 109.595 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 21.0 mmt180 -83.14 -20.81 34.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.159 -0.928 . . . . 2.91 110.437 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -103.78 6.28 36.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.893 -0.594 . . . . 1.88 110.957 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.6 p -114.3 -41.18 3.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.341 -0.39 . . . . 2.2 111.432 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -88.09 -0.66 57.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.759 0.314 . . . . 3.68 110.794 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -172.49 -139.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 4.31 110.15 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 79.6 mtp -132.61 108.46 9.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.694 0.283 . . . . 3.85 110.986 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -119.01 -102.72 0.42 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.261 -0.427 . . . . 1.92 111.139 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.9 t -173.75 135.12 0.5 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.845 0.355 . . . . 2.28 111.243 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -68.0 -21.56 65.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.129 -0.487 . . . . 1.3 109.755 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -75.08 -10.4 59.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.618 -0.719 . . . . 1.58 110.473 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.92 -48.41 14.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.044 -0.526 . . . . 0.33 110.098 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.463 ' CG2' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -73.17 -35.79 48.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.277 -0.638 . . . . 0.21 109.277 178.441 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.627 HD23 HD23 ' A' ' 104' ' ' LEU . 2.0 tm? -64.15 -54.9 26.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.037 -0.983 . . . . 0.24 110.689 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.08 -48.88 78.23 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.258 -0.428 . . . . 2.32 111.726 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.2 -25.1 65.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.066 -0.516 . . . . 0.29 110.893 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.559 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -83.55 -30.15 30.78 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.176 -1.011 . . . . 0.4 112.402 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.77 ' HD2' HD13 ' A' ' 101' ' ' LEU . 15.7 mmmt -63.99 -35.23 80.01 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.977 -1.12 . . . . 0.83 107.977 177.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -70.0 -43.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.479 -1.237 . . . . 0.53 109.9 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.854 HD12 HD22 ' A' ' 97' ' ' LEU . 3.4 tm? -59.08 -48.1 82.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.298 -0.864 . . . . 1.41 110.147 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.555 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 10.7 t80 -61.14 -33.25 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.908 -0.587 . . . . 0.75 109.64 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 t -73.29 -26.85 61.24 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.673 -0.694 . . . . 1.13 112.03 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -81.61 -43.55 18.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 119.725 -0.79 . . . . 0.28 109.452 -178.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.403 ' SG ' HG22 ' A' ' 39' ' ' VAL . 15.4 m -64.31 -43.8 93.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.704 -0.68 . . . . 0.9 109.672 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.93 -39.75 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.955 -0.566 . . . . 0.43 111.995 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.4 t -86.73 -11.21 51.78 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.997 -0.681 . . . . 0.9 110.441 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.522 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.6 OUTLIER -90.68 -23.96 20.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.755 -0.657 . . . . 0.25 112.146 -179.395 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.49 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.6 m -70.28 -8.4 10.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.182 0.515 . . . . 0.98 111.221 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -74.77 -0.99 20.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.861 -0.609 . . . . 1.31 110.357 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 80.2 p -114.05 4.79 15.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.962 -0.563 . . . . 1.49 111.325 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.607 HG21 ' HB2' ' A' ' 87' ' ' LYS . 25.0 mm -70.4 92.88 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 116.474 -0.33 . . . . 1.39 111.197 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.532 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -59.81 -34.76 73.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.781 -0.822 . . . . 2.55 108.781 178.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.532 ' N ' ' HG3' ' A' ' 82' ' ' GLN . 19.5 mp0 -60.82 172.14 1.02 Allowed 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 114.905 -1.043 . . . . 2.56 109.969 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 4.9 ptm -144.06 -43.77 0.26 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.326 -0.397 . . . . 2.71 111.335 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -81.99 9.69 7.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.665 0.745 . . . . 2.78 109.045 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.475 ' OD1' ' HB3' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -126.89 -32.51 2.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.587 -1.188 . . . . 2.49 110.041 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.607 ' HB2' HG21 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -50.65 -44.63 57.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.387 -0.824 . . . . 2.28 111.067 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.522 ' N ' ' HD2' ' A' ' 87' ' ' LYS . 2.2 p90 -56.89 -46.8 81.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.4 0.619 . . . . 2.49 110.219 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -52.77 -59.7 4.17 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.949 -1.023 . . . . 0.35 112.193 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.622 ' CE1' HG22 ' A' ' 131' ' ' ILE . 68.8 t80 -66.13 -48.09 71.96 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.263 0.468 . . . . 0.28 112.263 -179.083 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.516 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.5 OUTLIER -56.61 -52.92 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.462 -0.335 . . . . 3.34 110.795 -177.728 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.5 pt-20 -55.52 -36.87 67.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 2.58 110.382 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.2 -39.25 85.88 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.433 0.635 . . . . 0.29 109.731 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.604 HD11 ' CE2' ' A' ' 90' ' ' PHE . 21.2 mt -62.63 -40.97 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.404 0 CA-C-N 115.357 -0.838 . . . . 0.24 108.806 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.45 ' OD1' ' HD2' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -58.51 -40.83 83.97 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.497 -1.229 . . . . 0.33 109.186 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 11.0 mptt -51.95 -49.89 62.26 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.374 -0.375 . . . . 1.64 110.133 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.854 HD22 HD12 ' A' ' 70' ' ' LEU . 30.7 tp -58.44 -32.25 68.53 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 116.079 -0.51 . . . . 0.62 110.606 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.59 -60.08 4.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.373 -0.376 . . . . 1.87 110.495 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -72.59 -10.04 59.31 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.119 -0.491 . . . . 2.12 111.587 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.465 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.72 -43.95 21.68 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.37 -0.974 . . . . 0.26 108.37 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.77 HD13 ' HD2' ' A' ' 68' ' ' LYS . 10.5 mt -68.11 -33.19 74.05 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.053 -0.976 . . . . 0.58 108.45 178.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -54.95 -55.55 29.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.854 -1.066 . . . . 2.09 110.534 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -71.76 -21.95 61.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.001 0.429 . . . . 2.32 110.575 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.627 HD23 HD23 ' A' ' 64' ' ' LEU . 29.3 tp -77.77 -17.99 56.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.31 111.339 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.509 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -51.87 162.27 0.45 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.322 -0.399 . . . . 2.04 111.234 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.655 HG23 ' H ' ' A' ' 107' ' ' CYS . 0.7 OUTLIER -56.13 -66.9 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.265 -0.425 . . . . 1.69 111.517 -179.635 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.655 ' H ' HG23 ' A' ' 106' ' ' ILE . 11.2 t 67.82 144.48 0.1 OUTLIER Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.375 -0.375 . . . . 2.44 110.511 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.563 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 51.7 Cg_exo -53.23 -66.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.513 2.142 . . . . 3.01 112.84 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.429 ' HB1' ' HA ' ' A' ' 113' ' ' SER . . . -165.34 4.43 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.58 -0.282 . . . . 4.42 111.464 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.1 m -54.05 -30.71 49.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.369 -0.378 . . . . 5.41 111.245 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.42 29.14 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 5.83 111.261 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 129.59 -100.82 0.51 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.888 -0.673 . . . . 5.16 112.228 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.429 ' HA ' ' HB1' ' A' ' 109' ' ' ALA . 45.6 t -170.93 -99.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.868 0.366 . . . . 4.55 111.259 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLY . . . . . 0.453 ' H ' ' HD2' ' A' ' 115' ' ' PRO . . . -140.9 -68.02 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.996 -0.621 . . . . 4.42 112.678 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.453 ' HD2' ' H ' ' A' ' 114' ' ' GLY . 25.7 Cg_endo -62.21 -57.13 0.53 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.445 2.097 . . . . 5.57 112.354 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -92.73 102.6 15.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 3.79 110.852 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -138.03 -35.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 2.68 111.5 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.4 p 56.32 104.19 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.455 0.645 . . . . 2.42 110.989 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -105.89 83.52 1.93 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.164 -0.926 . . . . 2.35 111.225 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -125.0 82.58 2.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.41 -0.814 . . . . 2.16 109.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.517 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.6 OUTLIER -80.05 42.66 0.57 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.86 -0.609 . . . . 0.47 111.951 -177.937 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 43.9 m -66.82 -15.91 63.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.917 -0.401 . . . . 1.26 109.917 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.452 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 3.0 mppt? -70.89 -44.38 66.42 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.715 -0.846 . . . . 2.58 108.715 178.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.496 HD12 ' O ' ' A' ' 124' ' ' LEU . 1.4 tp -60.23 -22.1 62.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.463 -0.789 . . . . 0.26 108.945 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -48.81 29.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.258 -0.883 . . . . 1.3 109.872 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.1 m -67.12 -31.68 72.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.703 -0.681 . . . . 1.4 110.667 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.473 ' O ' HG13 ' A' ' 131' ' ' ILE . 68.6 m -66.98 -41.73 86.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 1.09 111.218 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.568 HG13 ' HB ' ' A' ' 43' ' ' THR . 26.2 t -63.42 -56.16 18.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.13 -0.486 . . . . 0.51 111.074 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.0 mmtt -52.67 -36.48 57.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.56 -0.746 . . . . 2.69 111.341 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.408 ' O ' HG13 ' A' ' 134' ' ' ILE . 40.3 tt0 -62.5 -51.61 66.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.106 -0.497 . . . . 2.1 112.278 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.622 HG22 ' CE1' ' A' ' 90' ' ' PHE . 1.3 mt -55.23 -55.23 17.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 C-N-CA 120.942 -0.303 . . . . 0.29 110.96 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.1 p -55.21 -45.77 75.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 1.02 111.275 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.79 -31.29 58.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.37 111.739 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.598 HG23 HH21 ' A' ' 137' ' ' ARG . 91.1 mt -74.78 -51.25 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 112.877 0.695 . . . . 0.26 112.877 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.626 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.57 -41.62 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 112.296 0.48 . . . . 0.25 112.296 -179.056 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -55.1 -31.96 61.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.309 -0.405 . . . . 0.91 111.848 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.598 HH21 HG23 ' A' ' 134' ' ' ILE . 3.3 mtm180 -99.46 -17.2 18.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.404 0.621 . . . . 4.06 109.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 135' ' ' VAL . 4.2 tt -58.75 -89.13 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.083 -0.962 . . . . 1.89 110.664 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.454 ' H ' ' HB3' ' A' ' 138' ' ' LEU . 45.0 mt-10 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.259 -0.876 . . . . 4.17 110.951 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.853 0.359 . . . . 4.47 110.644 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.24 40.58 49.15 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 2.5 111.961 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 46.76 23.44 0.25 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.115 0.413 . . . . 2.01 112.115 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.633 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.0 mm 63.7 111.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.757 -0.656 . . . . 0.39 112.065 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.551 ' O ' HG12 ' A' ' 38' ' ' VAL . 77.5 p -129.55 -159.42 0.96 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.291 -0.868 . . . . 0.36 109.483 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.685 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.3 -30.86 60.49 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.384 -0.527 . . . . 0.99 109.733 178.463 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -60.85 -46.14 95.12 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.539 -0.755 . . . . 0.15 112.046 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.633 HG11 ' HA ' ' A' ' 34' ' ' ILE . 10.8 p -66.97 -39.3 83.14 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 1.28 109.522 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.446 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -63.23 -43.38 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 114.825 -1.079 . . . . 0.17 110.876 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.473 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.2 mt -63.11 -46.85 85.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.71 0.29 . . . . 0.21 110.521 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.9 -32.63 67.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.966 0.412 . . . . 0.24 110.224 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.803 ' CB ' HD23 ' A' ' 70' ' ' LEU . 39.3 m -77.47 -35.45 53.79 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.747 -0.661 . . . . 0.34 111.371 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.478 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.3 OUTLIER -73.31 -26.6 61.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.509 . . . . 0.42 109.816 178.545 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -79.11 -47.26 16.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.509 -0.769 . . . . 1.52 110.161 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.51 -47.29 63.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.054 -0.521 . . . . 0.28 111.024 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.616 HD22 ' HA2' ' A' ' 67' ' ' GLY . 4.2 pp -69.97 -40.28 75.48 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.821 -0.352 . . . . 0.3 110.182 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.549 ' N ' HD12 ' A' ' 46' ' ' LEU . 53.9 t -57.31 -41.69 80.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.043 -0.526 . . . . 0.23 110.889 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mp -65.88 -39.86 91.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 1.2 110.238 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.84 -39.65 71.71 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.78 -0.452 . . . . 0.28 109.78 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -70.12 -38.5 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.228 0 N-CA-C 108.902 -0.777 . . . . 0.21 108.902 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -71.14 -14.55 62.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.45 109.18 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.65 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . 15.5 mtp180 -91.94 -18.55 23.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.266 -0.879 . . . . 2.91 111.137 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -95.54 3.13 54.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.101 -0.5 . . . . 1.88 110.707 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -115.11 -29.28 6.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.271 -0.422 . . . . 2.2 111.255 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -108.58 -15.26 14.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 3.68 110.666 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 18.0 mp0 -141.31 -147.68 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.871 -0.604 . . . . 4.31 110.015 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.8 mtp -136.53 70.13 1.41 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.413 -0.358 . . . . 3.85 110.897 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.65 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . . . -80.56 -101.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 1.92 110.86 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.3 t -172.39 136.76 0.81 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.266 0.555 . . . . 2.28 112.086 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -68.05 -29.45 68.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.351 -0.841 . . . . 1.3 110.013 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -77.61 -5.11 49.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 1.58 111.17 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.97 -48.98 10.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.973 0.416 . . . . 0.33 110.515 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.531 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -68.05 -39.48 81.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.826 -0.624 . . . . 0.21 110.258 179.334 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 104' ' ' LEU . 1.1 tm? -65.02 -56.06 15.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.442 -0.799 . . . . 0.24 111.224 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.14 -44.04 95.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.342 -0.39 . . . . 2.32 111.596 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.63 -45.71 85.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.041 -0.527 . . . . 0.29 111.063 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.616 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -62.87 -31.36 80.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.335 -0.936 . . . . 0.4 112.578 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -44.31 96.14 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.464 -0.939 . . . . 0.83 108.464 177.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -62.68 -38.63 91.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.61 -1.177 . . . . 0.53 110.341 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.803 HD23 ' CB ' ' A' ' 42' ' ' SER . 2.8 tm? -65.77 -49.97 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.472 -0.785 . . . . 1.41 111.069 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -53.6 -34.88 59.99 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.735 -0.839 . . . . 0.75 108.735 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.0 m -68.46 -49.67 58.14 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.042 -0.981 . . . . 1.13 111.444 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -57.25 -43.57 83.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.92 -0.712 . . . . 0.28 110.581 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.457 ' O ' HG13 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -60.74 -29.33 69.31 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.766 -0.652 . . . . 0.9 109.838 178.578 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -37.13 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.489 -0.778 . . . . 0.43 111.36 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.3 t -89.59 -9.03 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.9 110.977 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.523 ' HB2' HG22 ' A' ' 34' ' ' ILE . 1.6 t80 -94.63 -29.6 14.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.0 -0.545 . . . . 0.25 111.614 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.475 ' O ' HG12 ' A' ' 81' ' ' ILE . 3.6 m -61.65 -11.92 6.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.148 0.499 . . . . 0.98 111.034 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -80.19 8.67 6.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.769 -0.65 . . . . 1.31 109.877 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 58.5 m -117.53 -8.99 10.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.694 -0.685 . . . . 1.49 110.693 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.56 HG21 ' HG3' ' A' ' 87' ' ' LYS . 34.6 mm -56.91 106.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 116.106 -0.497 . . . . 1.39 110.869 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.484 ' HG3' ' H ' ' A' ' 83' ' ' GLN . 1.3 pp0? -67.93 -48.39 66.09 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.936 0.398 . . . . 2.55 110.133 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.58 ' HB2' ' ND2' ' A' ' 86' ' ' ASN . 75.5 mt-30 -59.31 -174.55 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.77 -0.65 . . . . 2.56 109.955 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -152.46 -40.34 0.11 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.349 -0.54 . . . . 2.71 111.582 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -73.78 -1.9 21.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.642 0.734 . . . . 2.78 109.052 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.588 ' ND2' ' N ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -115.65 -25.57 7.79 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.943 -1.026 . . . . 2.49 110.611 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.588 ' N ' ' ND2' ' A' ' 86' ' ' ASN . 1.0 OUTLIER -45.47 -48.93 13.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.798 -0.637 . . . . 2.28 111.083 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -56.2 -43.0 78.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.793 -0.64 . . . . 2.49 110.75 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -55.24 -61.24 2.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.271 0.471 . . . . 0.35 112.271 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.651 ' CE2' HD11 ' A' ' 94' ' ' ILE . 88.9 t80 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.195 0.442 . . . . 0.28 112.195 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.06 -55.03 31.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 3.34 110.654 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.4 pt-20 -58.55 -34.3 70.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 2.58 110.564 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -59.99 -37.99 81.29 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.494 0.664 . . . . 0.29 109.823 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.651 HD11 ' CE2' ' A' ' 90' ' ' PHE . 11.0 mt -66.11 -36.22 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 115.336 -0.847 . . . . 0.24 109.123 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.481 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 0.1 OUTLIER -61.74 -32.09 72.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.86 -1.063 . . . . 0.33 109.22 179.115 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 0.7 OUTLIER -63.89 -48.67 75.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.526 -0.546 . . . . 1.64 109.526 178.581 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.743 ' CD2' HD12 ' A' ' 70' ' ' LEU . 23.5 tp -58.11 -33.59 69.29 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 116.165 -0.47 . . . . 0.62 109.951 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.494 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 7.5 tp10 -57.75 -59.24 5.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.892 -0.594 . . . . 1.87 110.424 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.566 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 29.3 m-80 -72.75 -9.93 59.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 2.12 111.181 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.5 ' OD1' HD13 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -78.41 -47.94 16.51 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 108.683 -0.858 . . . . 0.26 108.683 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 5.9 mt -65.5 -34.44 78.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.323 -0.991 . . . . 0.58 108.323 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.566 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 98.2 mtt180 -55.49 -50.03 70.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.942 -1.026 . . . . 2.09 111.256 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.75 -22.13 50.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.106 0.479 . . . . 2.32 110.136 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 64' ' ' LEU . 42.0 tp -69.37 -17.31 63.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.721 -0.672 . . . . 0.31 110.83 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.497 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -48.26 130.2 15.98 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.769 0.319 . . . . 2.04 110.517 179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.509 HG23 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -56.18 -53.09 43.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 1.69 111.307 -179.012 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.509 ' N ' HG23 ' A' ' 106' ' ' ILE . 13.3 t 179.07 140.19 0.28 Allowed Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 120.542 0.21 . . . . 2.44 110.847 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.423 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 39.4 Cg_exo -57.56 -37.77 95.99 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.44 2.093 . . . . 3.01 111.467 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.586 ' HA ' ' HB2' ' A' ' 113' ' ' SER . . . 72.46 2.35 4.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.739 -1.119 . . . . 4.42 111.077 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.0 m -80.72 -27.37 36.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.026 -0.534 . . . . 5.41 110.838 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -86.76 -67.5 0.81 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.92 -0.582 . . . . 5.83 111.364 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -152.49 -27.57 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.693 -0.765 . . . . 5.16 112.854 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.586 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 47.9 t 63.9 164.11 0.13 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.979 0.418 . . . . 4.55 111.407 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 164.81 142.18 3.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.812 -0.708 . . . . 4.42 112.335 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 105.97 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 5.57 112.216 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -71.57 -43.31 66.56 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 3.79 111.389 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . 61.51 -174.42 0.13 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.352 -0.385 . . . . 2.68 111.345 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 43.3 p 47.42 75.98 0.12 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.99 0.9 . . . . 2.42 110.971 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -87.51 84.88 7.08 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.822 -1.535 . . . . 2.35 111.309 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -104.71 81.51 1.78 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.293 -0.632 . . . . 2.16 109.293 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.468 ' HB2' HG21 ' A' ' 50' ' ' ILE . 2.0 m-30 -104.38 42.47 1.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.47 112.234 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 96.4 p -73.18 -17.15 61.4 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.702 -0.481 . . . . 1.26 109.702 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 123' ' ' LYS . 29.8 mmmt -66.83 -52.61 41.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 109.135 -0.691 . . . . 2.58 109.135 178.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.8 OUTLIER -51.41 -27.04 9.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.001 -0.999 . . . . 0.26 109.049 177.544 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.46 -49.71 38.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.266 -0.879 . . . . 1.3 110.214 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 89.7 p -64.43 -34.26 77.78 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.903 -0.59 . . . . 1.4 111.128 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 t -62.31 -46.88 86.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 1.09 111.529 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.478 HG13 ' HB ' ' A' ' 43' ' ' THR . 53.8 t -60.87 -50.23 81.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.51 111.311 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -50.71 -43.82 57.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.035 -0.53 . . . . 2.69 110.92 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.414 ' O ' HG13 ' A' ' 134' ' ' ILE . 10.9 tp10 -59.26 -55.47 34.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.638 -0.71 . . . . 2.1 112.79 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.585 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.0 OUTLIER -51.36 -55.07 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-O 120.826 0.346 . . . . 0.29 111.299 -178.497 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 41.2 t -53.61 -48.4 69.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.11 -0.496 . . . . 1.02 111.048 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.87 -29.84 30.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.103 0.408 . . . . 0.37 112.103 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.581 HG23 HH21 ' A' ' 137' ' ' ARG . 65.7 mt -76.8 -51.31 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 113.012 0.745 . . . . 0.26 113.012 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.685 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -58.03 -44.9 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.536 0.939 . . . . 0.25 113.536 -178.172 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -44.18 -40.58 5.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.825 0.676 . . . . 0.91 112.825 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.581 HH21 HG23 ' A' ' 134' ' ' ILE . 9.9 mtm180 -84.31 -25.15 29.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.317 0.579 . . . . 4.06 109.911 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.623 HD13 ' N ' ' A' ' 139' ' ' GLU . 0.5 OUTLIER -69.06 -63.96 0.96 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.061 -0.972 . . . . 1.89 110.811 179.695 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.623 ' N ' HD13 ' A' ' 138' ' ' LEU . 40.6 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.138 -0.934 . . . . 4.17 111.399 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.762 0.315 . . . . 4.47 111.277 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 57.98 28.58 61.06 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.749 -0.739 . . . . 2.5 112.494 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 47.31 19.76 0.13 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.528 0.566 . . . . 2.01 112.528 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.457 HG22 ' HB2' ' A' ' 77' ' ' TYR . 50.7 mm 58.88 97.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 0.39 111.954 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.7 p -127.95 -175.95 3.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.626 -0.715 . . . . 0.36 109.649 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.623 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.74 -34.29 77.83 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.372 -0.531 . . . . 0.99 109.775 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.448 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.0 -43.71 98.8 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.676 -0.773 . . . . 0.15 111.2 178.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.1 t -69.08 -40.36 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.591 0.71 . . . . 1.28 109.559 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.26 -44.16 97.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.639 -1.164 . . . . 0.17 110.826 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.466 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 25.1 mt -60.58 -47.4 86.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.722 0.296 . . . . 0.21 110.602 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -56.35 -31.47 63.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.24 110.219 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.779 ' CB ' HD23 ' A' ' 70' ' ' LEU . 41.8 m -77.86 -34.85 51.53 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.761 -0.654 . . . . 0.34 111.277 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.476 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.2 OUTLIER -73.43 -29.14 62.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.42 109.805 178.56 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -79.23 -45.76 19.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.698 -0.683 . . . . 1.52 110.218 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.61 -47.19 63.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.043 -0.526 . . . . 0.28 110.786 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.583 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.24 -39.97 82.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.526 -0.47 . . . . 0.3 110.055 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.583 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.9 t -56.85 -41.45 77.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.211 -0.45 . . . . 0.23 110.756 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.71 -39.15 90.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 1.2 110.191 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.68 -34.11 69.07 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.408 -0.59 . . . . 0.28 109.408 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.585 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -72.17 -30.33 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 109.037 -0.727 . . . . 0.21 109.037 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -81.62 -13.16 58.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.158 -0.928 . . . . 0.45 109.689 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.489 ' C ' ' H ' ' A' ' 54' ' ' SER . 98.8 mtt180 -96.3 -17.03 20.99 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.599 -0.728 . . . . 2.91 111.205 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.76 ' HA ' ' H ' ' A' ' 58' ' ' ALA . 9.1 t30 -66.96 11.85 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 1.88 111.522 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.489 ' H ' ' C ' ' A' ' 52' ' ' ARG . 54.3 m -139.02 -23.42 0.92 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.613 0.244 . . . . 2.2 111.13 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -76.03 -35.23 59.59 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.494 -0.321 . . . . 3.68 111.58 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.59 31.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.025 0.44 . . . . 4.31 110.88 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 84.1 mtp 60.07 96.67 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.613 -0.721 . . . . 3.85 111.681 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.76 ' H ' ' HA ' ' A' ' 53' ' ' ASN . . . -97.38 -20.8 17.57 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.043 -0.526 . . . . 1.92 110.532 179.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.548 ' HB2' ' O ' ' A' ' 58' ' ' ALA . 66.3 m 80.38 141.07 0.07 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.099 0.874 . . . . 2.28 111.581 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' A' ' 105' ' ' GLN . 5.3 p-80 -63.51 -27.61 69.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.779 -0.646 . . . . 1.3 109.91 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.7 m -64.97 -10.21 27.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.9 -0.591 . . . . 1.58 110.48 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.36 -51.46 7.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.917 -0.583 . . . . 0.33 110.193 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.585 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -72.13 -34.23 49.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.58 -0.736 . . . . 0.21 109.709 178.775 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' A' ' 105' ' ' GLN . 2.2 tm? -64.87 -53.29 49.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.205 -0.907 . . . . 0.24 110.325 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.45 -45.36 91.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.863 -0.608 . . . . 2.32 111.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.0 74.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.29 111.288 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.556 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -75.88 -30.4 57.72 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.097 -1.049 . . . . 0.4 112.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -64.21 -40.3 95.78 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.36 -0.978 . . . . 0.83 108.36 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.2 m-80 -65.38 -39.23 91.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.626 -1.17 . . . . 0.53 109.918 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.779 HD23 ' CB ' ' A' ' 42' ' ' SER . 3.0 tm? -65.55 -49.82 67.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.312 -0.858 . . . . 1.41 110.824 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -56.52 -32.8 65.44 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.28 -1.007 . . . . 0.75 108.28 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 35.0 t -65.04 -50.28 66.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.99 -1.005 . . . . 1.13 110.773 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.448 ' HB3' HG23 ' A' ' 34' ' ' ILE . 12.1 m-85 -63.11 -42.94 99.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.525 -0.47 . . . . 0.28 111.456 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -50.61 73.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.346 -0.388 . . . . 0.9 110.591 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 72' ' ' SER . 0.4 OUTLIER -55.56 -36.68 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.981 -0.554 . . . . 0.43 112.384 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.2 t -88.28 -9.89 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.098 0.475 . . . . 0.9 110.502 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.457 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -90.14 -27.97 19.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.629 -0.714 . . . . 0.25 111.295 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.2 m -69.24 -10.76 13.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.32 . . . . 0.98 111.422 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.96 -2.43 18.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.126 0.489 . . . . 1.31 110.021 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.4 t -111.61 -0.43 16.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.79 -0.641 . . . . 1.49 111.291 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.778 HG23 HD22 ' A' ' 86' ' ' ASN . 3.8 mm -54.99 103.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 109.839 -0.43 . . . . 1.39 109.839 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.607 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -72.17 -40.56 67.86 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.132 0.491 . . . . 2.55 109.786 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.607 ' N ' ' HG3' ' A' ' 82' ' ' GLN . 0.9 OUTLIER -58.99 178.54 0.11 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.487 -0.779 . . . . 2.56 109.401 179.297 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -136.39 -40.79 0.64 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.464 -0.494 . . . . 2.71 112.147 -178.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -88.88 33.09 0.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.349 0.595 . . . . 2.78 109.445 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.778 HD22 HG23 ' A' ' 81' ' ' ILE . 11.3 p-10 -133.9 -33.68 1.04 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.237 -0.892 . . . . 2.49 111.035 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 20.6 tptp -37.88 -55.22 1.22 Allowed 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.814 -0.63 . . . . 2.28 111.66 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.572 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 97.3 m-85 -56.05 -48.15 76.55 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.056 -0.52 . . . . 2.49 110.901 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.43 -66.29 0.42 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.83 0.347 . . . . 0.35 111.615 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.63 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.9 t80 -65.23 -49.1 70.97 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.995 0.739 . . . . 0.28 112.995 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.616 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 12.2 ttt180 -54.77 -64.1 0.94 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.061 0.393 . . . . 3.34 112.061 -176.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -51.6 -37.43 49.89 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.524 -0.547 . . . . 2.58 109.524 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -56.92 -41.01 77.41 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.732 -0.667 . . . . 0.29 109.531 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.63 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -61.85 -39.12 82.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 108.951 -0.759 . . . . 0.24 108.951 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 0.1 OUTLIER -60.4 -32.06 70.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.607 -1.179 . . . . 0.33 109.695 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 10.6 mptt -62.57 -49.21 76.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.688 -0.486 . . . . 1.64 109.688 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.675 ' CD2' HD12 ' A' ' 70' ' ' LEU . 27.7 tp -59.06 -34.24 71.72 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.634 -0.426 . . . . 0.62 110.135 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 8.0 tp10 -55.42 -57.66 10.96 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.031 -0.531 . . . . 1.87 110.185 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 45.6 m-80 -63.92 -40.02 95.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 2.12 111.123 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.579 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -51.05 -48.65 61.49 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.26 109.999 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.579 ' HG ' HD22 ' A' ' 100' ' ' ASN . 5.6 mt -67.25 -38.5 85.27 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.261 -0.644 . . . . 0.58 109.261 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.505 ' O ' ' OE1' ' A' ' 105' ' ' GLN . 64.7 mtp180 -54.92 -37.59 66.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.275 -0.875 . . . . 2.09 111.473 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -90.59 -15.49 30.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.244 -0.434 . . . . 2.32 111.616 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.565 HD11 ' CE2' ' A' ' 121' ' ' PHE . 6.3 tp -87.3 -22.15 25.32 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.167 1.173 . . . . 0.31 114.167 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.745 ' NE2' HG22 ' A' ' 106' ' ' ILE . 1.4 pm0 -61.56 -29.94 70.34 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.776 -0.37 . . . . 2.04 111.795 -178.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.745 HG22 ' NE2' ' A' ' 105' ' ' GLN . 0.3 OUTLIER -179.75 -52.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.303 0.483 . . . . 1.69 112.303 178.649 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.637 ' H ' ' NE2' ' A' ' 105' ' ' GLN . 53.1 t 67.1 142.38 0.08 OUTLIER Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.376 -0.375 . . . . 2.44 110.653 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.447 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 24.8 Cg_exo -63.37 -65.7 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.59 2.193 . . . . 3.01 112.392 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.402 ' H ' ' H ' ' A' ' 110' ' ' THR . . . -165.27 -5.5 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.306 -0.406 . . . . 4.42 111.005 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.402 ' H ' ' H ' ' A' ' 109' ' ' ALA . 36.5 m -57.58 -31.93 66.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 5.41 111.25 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -155.0 116.35 4.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.261 -0.427 . . . . 5.83 111.395 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.58 82.91 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.914 -0.66 . . . . 5.16 112.536 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.4 m -64.79 -93.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.953 0.406 . . . . 4.55 111.239 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -75.63 -168.76 25.27 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.868 -0.605 . . . . 4.42 112.606 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.74 -13.4 32.17 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 122.222 1.948 . . . . 5.57 112.213 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -108.88 98.24 7.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.003 -0.544 . . . . 3.79 110.933 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -158.19 -61.31 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 2.68 111.146 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.9 t 177.14 108.83 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.812 -0.631 . . . . 2.42 111.114 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -93.8 83.7 4.45 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.244 -0.889 . . . . 2.35 110.652 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -140.6 81.19 1.79 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.215 -0.902 . . . . 2.16 109.609 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.565 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.1 m-30 -86.61 42.5 1.01 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 0.47 111.233 -178.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m -77.82 -14.28 59.62 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.855 -0.338 . . . . 1.26 110.449 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.454 ' HB2' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.8 -42.57 63.75 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.007 -0.738 . . . . 2.58 109.007 179.007 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.485 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.25 -23.73 67.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.538 -0.912 . . . . 0.26 108.538 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.9 -48.47 30.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.858 -1.064 . . . . 1.3 110.089 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.7 t -63.05 -34.53 77.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.022 -0.535 . . . . 1.4 110.881 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 70.4 m -63.21 -48.64 77.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.968 -0.56 . . . . 1.09 111.502 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.476 HG13 ' HB ' ' A' ' 43' ' ' THR . 64.8 t -58.53 -52.89 54.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.864 0.364 . . . . 0.51 111.295 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -50.8 -42.26 57.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 2.69 111.271 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.6 tt0 -58.1 -56.11 26.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 2.1 112.265 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.575 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.89 -55.7 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 120.946 0.403 . . . . 0.29 111.111 -178.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 40.0 t -54.03 -47.68 71.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.04 -0.527 . . . . 1.02 110.407 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.512 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 15.6 t70 -56.51 -20.28 19.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.37 111.858 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.426 HG21 ' N ' ' A' ' 90' ' ' PHE . 89.9 mt -89.15 -30.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.731 0.641 . . . . 0.26 112.731 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.623 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -83.05 -50.94 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 114.665 1.358 . . . . 0.25 114.665 -177.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLN . . . . . 0.707 ' HB2' HH21 ' A' ' 137' ' ' ARG . 39.8 mt-30 -46.18 -68.82 0.16 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.338 0.866 . . . . 0.91 113.338 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.707 HH21 ' HB2' ' A' ' 136' ' ' GLN . 0.2 OUTLIER -76.32 35.15 0.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.052 0.454 . . . . 4.06 111.135 -179.663 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.517 HD13 ' N ' ' A' ' 139' ' ' GLU . 1.0 OUTLIER -130.82 -55.84 1.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.022 -0.535 . . . . 1.89 110.808 -179.487 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.517 ' N ' HD13 ' A' ' 138' ' ' LEU . 4.5 pt-20 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.106 -0.95 . . . . 4.17 110.937 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.746 0.308 . . . . 4.47 111.065 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 71.45 -109.7 2.94 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.035 -0.602 . . . . 2.5 112.467 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.64 15.35 2.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.912 0.387 . . . . 2.01 111.148 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.459 HG23 ' HB3' ' A' ' 73' ' ' PHE . 48.8 mm 66.47 100.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.661 . . . . 0.39 111.91 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 p -127.64 -178.25 4.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.576 -0.738 . . . . 0.36 109.296 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.621 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -62.52 -37.71 87.1 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.2 -0.6 . . . . 0.99 110.014 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.52 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -57.75 -46.75 91.91 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.635 -0.793 . . . . 0.15 111.147 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.6 t -65.42 -38.48 82.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.508 0.671 . . . . 1.28 109.525 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.39 95.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 114.806 -1.088 . . . . 0.17 110.374 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.458 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 19.1 mt -60.92 -48.33 82.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.203 -0.453 . . . . 0.21 110.466 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.3 -28.85 63.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.079 0.466 . . . . 0.24 110.273 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.809 ' HB2' HD23 ' A' ' 70' ' ' LEU . 58.0 m -78.87 -35.48 43.68 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.705 -0.679 . . . . 0.34 110.926 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.499 HG23 HD21 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -73.69 -26.97 60.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.208 0.528 . . . . 0.42 109.909 178.464 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -80.93 -50.03 10.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.532 -0.758 . . . . 1.52 109.922 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.3 -46.71 36.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.005 -0.543 . . . . 0.28 110.838 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.636 HD22 ' HA2' ' A' ' 67' ' ' GLY . 4.2 pp -69.87 -41.81 74.32 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.879 -0.415 . . . . 0.3 109.879 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.1 t -53.82 -45.59 70.86 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.222 -0.444 . . . . 0.23 110.949 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.98 -42.86 99.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.2 110.185 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.46 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . . . -55.14 -30.29 59.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.204 -0.453 . . . . 0.28 110.166 178.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.606 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.2 mt -74.64 -39.17 46.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.289 -0.634 . . . . 0.21 109.289 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.2 t -77.18 -10.22 59.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.232 -0.895 . . . . 0.45 109.951 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.46 ' HE ' ' HA ' ' A' ' 49' ' ' ALA . 69.4 mtm180 -94.33 -12.08 28.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.591 -0.731 . . . . 2.91 110.832 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.596 ' HA ' ' H ' ' A' ' 58' ' ' ALA . 9.0 t30 -89.4 9.22 27.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 1.88 110.716 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.8 m -131.41 -32.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 2.2 111.114 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -92.23 -29.28 16.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 3.68 111.107 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -134.11 -2.02 2.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.313 -0.403 . . . . 4.31 111.016 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 83.6 mtp 56.08 67.46 1.0 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.154 -0.476 . . . . 3.85 110.822 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.596 ' H ' ' HA ' ' A' ' 53' ' ' ASN . . . -72.83 -88.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 1.92 111.192 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.5 t -179.88 138.66 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.945 0.402 . . . . 2.28 111.452 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -66.44 -21.58 66.2 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.406 -0.59 . . . . 1.3 109.406 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.7 t -76.65 -11.59 59.88 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.397 -0.82 . . . . 1.58 110.752 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -48.61 13.51 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.814 -0.439 . . . . 0.33 109.814 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.518 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -69.87 -36.29 68.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.136 -0.69 . . . . 0.21 109.136 178.465 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.59 HD23 ' HB3' ' A' ' 104' ' ' LEU . 2.4 tm? -61.89 -57.8 10.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.91 -1.041 . . . . 0.24 110.72 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.34 -42.67 99.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.895 -0.593 . . . . 2.32 111.837 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.54 -32.06 72.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.29 110.968 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.636 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -78.49 -29.68 51.91 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.178 -1.011 . . . . 0.4 112.117 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.66 -46.31 83.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 107.997 -1.112 . . . . 0.83 107.997 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -59.85 -42.12 92.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.475 -1.239 . . . . 0.53 110.015 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.809 HD23 ' HB2' ' A' ' 42' ' ' SER . 2.4 tm? -62.57 -49.12 76.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.335 -0.848 . . . . 1.41 110.686 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.545 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . 1.4 t80 -59.02 -36.13 74.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.724 -0.671 . . . . 0.75 109.938 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 9.0 p -74.19 -24.81 59.41 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.877 -0.601 . . . . 1.13 112.559 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.459 ' HB3' HG23 ' A' ' 34' ' ' ILE . 17.8 m-85 -78.78 -44.4 23.32 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 119.544 -0.862 . . . . 0.28 109.377 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.562 ' SG ' HG23 ' A' ' 94' ' ' ILE . 13.0 p -66.99 -21.72 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.37 -0.832 . . . . 0.9 109.534 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.412 HG12 ' N ' ' A' ' 76' ' ' SER . 0.6 OUTLIER -72.45 -43.93 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.43 110.09 179.001 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.412 ' N ' HG12 ' A' ' 75' ' ' VAL . 53.9 m -85.51 -2.5 58.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.9 110.253 178.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.442 ' HB3' ' O ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -99.26 -30.24 12.36 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.64 -0.709 . . . . 0.25 111.806 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.479 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.4 m -63.63 -2.86 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.121 0.415 . . . . 0.98 112.121 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -77.6 8.04 4.86 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.27 -0.423 . . . . 1.31 110.474 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.3 p -119.55 -10.45 9.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.032 -0.531 . . . . 1.49 110.884 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.533 HG21 ' HB2' ' A' ' 87' ' ' LYS . 35.6 mm -50.31 131.37 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 116.354 -0.385 . . . . 1.39 110.897 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.674 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.1 OUTLIER -111.8 -31.19 7.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 116.407 -0.36 . . . . 2.55 111.692 -178.989 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.467 ' HB3' ' HB2' ' A' ' 86' ' ' ASN . 4.0 mt-30 -43.99 -43.03 6.38 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.175 0.805 . . . . 2.56 113.175 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.674 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 23.7 mmt 80.73 -92.89 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.701 0.63 . . . . 2.71 112.701 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -57.82 -9.88 1.46 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.003 0.43 . . . . 2.78 111.077 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.467 ' HB2' ' HB3' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -107.95 -19.3 13.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.763 -0.653 . . . . 2.49 110.18 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.643 ' HD2' ' HA ' ' A' ' 84' ' ' MET . 0.0 OUTLIER -52.32 -38.74 59.36 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.324 0.583 . . . . 2.28 109.463 179.036 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.583 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 84.2 m-85 -57.41 -42.83 83.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.796 -1.093 . . . . 2.49 109.992 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.01 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.35 111.224 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.616 ' CE2' HD11 ' A' ' 94' ' ' ILE . 78.3 t80 -70.32 -45.59 65.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.31 -0.404 . . . . 0.28 111.917 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.671 ' HA ' HD12 ' A' ' 94' ' ' ILE . 9.4 ttp180 -56.73 -63.42 1.21 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.385 -0.37 . . . . 3.34 111.482 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -54.15 -34.8 61.28 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.325 -0.62 . . . . 2.58 109.325 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -57.45 -40.15 77.83 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.884 -0.784 . . . . 0.29 108.884 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.671 HD12 ' HA ' ' A' ' 91' ' ' ARG . 61.0 mt -60.48 -38.79 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 CA-C-N 115.139 -0.937 . . . . 0.24 109.085 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.4 -34.31 77.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.487 -1.233 . . . . 0.33 109.725 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 12.1 mptt -59.21 -45.26 91.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.657 -0.497 . . . . 1.64 109.657 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.711 ' CD2' HD12 ' A' ' 70' ' ' LEU . 28.7 tp -64.52 -31.77 73.12 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 116.339 -0.392 . . . . 0.62 110.305 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.1 -51.2 70.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.217 -0.447 . . . . 1.87 110.191 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 40.2 m-80 -72.65 -37.87 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.023 -0.535 . . . . 2.12 111.016 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.573 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -50.27 -45.54 54.44 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.499 -0.556 . . . . 0.26 109.499 178.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.573 ' HG ' HD22 ' A' ' 100' ' ' ASN . 7.5 mt -66.82 -38.86 87.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.364 -0.835 . . . . 0.58 109.14 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 48.6 mtt-85 -57.6 -35.12 70.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.427 -0.806 . . . . 2.09 111.214 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -88.02 -18.47 28.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.169 0.509 . . . . 2.32 109.845 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.59 ' HB3' HD23 ' A' ' 64' ' ' LEU . 14.9 tp -81.1 -34.67 32.46 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 114.092 1.145 . . . . 0.31 114.092 -178.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.424 ' OE1' ' O ' ' A' ' 102' ' ' ARG . 1.2 pm0 -73.73 165.44 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.103 -0.639 . . . . 2.04 110.457 -177.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.715 HG23 ' H ' ' A' ' 107' ' ' CYS . 1.5 tp -36.46 -75.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 112.64 0.608 . . . . 1.69 112.64 -178.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.715 ' H ' HG23 ' A' ' 106' ' ' ILE . 0.0 OUTLIER 63.38 151.12 0.11 Allowed Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 110.48 -0.193 . . . . 2.44 110.48 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.455 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 69.5 Cg_exo -49.91 -77.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.356 2.038 . . . . 3.01 112.714 -179.359 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 178.59 22.06 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 4.42 111.013 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.0 m -44.31 -37.66 3.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.882 -0.599 . . . . 5.41 111.498 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -91.53 -34.03 14.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 5.83 111.431 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 133.62 70.8 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.936 -0.649 . . . . 5.16 112.239 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.4 m -80.36 101.47 8.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.771 0.32 . . . . 4.55 111.585 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -161.99 162.13 33.91 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.1 -0.571 . . . . 4.42 112.109 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.91 61.16 4.66 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.876 2.384 . . . . 5.57 112.065 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -174.2 18.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 3.79 110.856 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -108.34 135.81 49.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.409 . . . . 2.68 111.5 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.1 p -91.87 86.7 5.98 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-O 122.357 1.075 . . . . 2.42 109.778 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -102.91 84.18 2.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.173 -1.831 . . . . 2.35 111.425 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -96.79 144.25 26.94 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.731 -1.211 . . . . 2.16 107.731 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.474 ' CD2' HD11 ' A' ' 104' ' ' LEU . 2.7 m-30 -107.34 41.87 1.42 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.673 -0.411 . . . . 0.47 111.644 -177.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 93.6 p -83.08 -25.57 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.709 -0.478 . . . . 1.26 109.709 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -67.17 -31.07 71.23 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.32 -0.993 . . . . 2.58 108.32 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.484 HD12 ' O ' ' A' ' 124' ' ' LEU . 2.2 tp -70.11 -22.95 62.97 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.155 -0.929 . . . . 0.26 108.55 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.82 -49.67 19.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.066 -0.97 . . . . 1.3 110.069 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 m -67.12 -30.1 70.02 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.93 -0.577 . . . . 1.4 110.486 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.5 m -65.56 -44.76 85.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.831 -0.622 . . . . 1.09 111.11 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 43' ' ' THR . 41.7 t -61.64 -53.8 43.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.51 111.32 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -51.87 -39.14 58.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.208 -0.451 . . . . 2.69 111.118 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' HG13 ' A' ' 134' ' ' ILE . 0.9 OUTLIER -61.03 -50.8 71.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 2.1 112.311 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.562 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.0 OUTLIER -55.18 -55.48 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.78 0.324 . . . . 0.29 111.053 -178.826 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.1 t -53.48 -45.56 69.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 1.02 111.131 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.71 -34.0 50.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.004 0.372 . . . . 0.37 112.004 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 130' ' ' GLU . 52.6 mt -74.42 -51.23 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.661 0.615 . . . . 0.26 112.661 -179.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.673 ' O ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -56.79 -35.51 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 112.517 0.562 . . . . 0.25 112.517 -178.752 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLN . . . . . 0.593 ' C ' ' HE ' ' A' ' 137' ' ' ARG . 43.1 mt-30 -67.99 -40.61 83.05 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.701 -0.4 . . . . 0.91 110.307 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.627 ' HA ' ' HE ' ' A' ' 137' ' ' ARG . 0.1 OUTLIER -90.54 48.33 1.53 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 122.054 0.931 . . . . 4.06 110.096 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.673 ' HB2' ' O ' ' A' ' 135' ' ' VAL . 1.1 tt -98.04 -91.48 0.26 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 113.787 -1.551 . . . . 1.89 111.541 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.423 -0.798 . . . . 4.17 111.161 179.791 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.694 0.283 . . . . 4.47 111.0 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.28 -33.2 83.54 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.638 -0.792 . . . . 2.5 112.059 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.05 16.85 2.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.435 . . . . 2.01 110.328 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.5 mm -143.69 90.27 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 CA-C-N 115.651 -0.704 . . . . 0.39 110.726 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.5 p -129.22 -175.27 3.51 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.734 . . . . 0.36 109.347 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.636 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -63.41 -30.99 72.02 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.203 -0.666 . . . . 0.99 109.203 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.441 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.52 -47.81 79.98 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.134 -0.787 . . . . 0.15 111.134 178.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 52.2 t -63.91 -40.3 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 CA-C-O 121.682 0.753 . . . . 1.28 109.25 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -39.84 86.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.339 -1.3 . . . . 0.17 110.8 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.419 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 20.5 mt -65.81 -49.24 68.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.434 -0.348 . . . . 0.21 110.422 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -54.38 -33.51 59.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.59 -0.522 . . . . 0.24 109.59 178.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m -70.97 -41.72 70.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.561 -0.745 . . . . 0.34 110.789 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.684 HG23 HD11 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -63.75 -33.2 75.13 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.948 0.404 . . . . 0.42 110.703 179.374 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -72.74 -55.05 7.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 1.52 111.367 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.11 -47.51 23.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.28 111.296 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.759 HD21 HD22 ' A' ' 70' ' ' LEU . 4.1 pp -71.08 -38.88 72.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.3 110.08 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.438 ' N ' HD12 ' A' ' 46' ' ' LEU . 34.6 t -53.89 -52.27 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 0.23 110.416 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mp -60.2 -35.03 74.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.033 -0.53 . . . . 1.2 110.003 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -60.23 -35.58 75.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.28 109.75 178.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.0 mt -69.56 -40.2 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 N-CA-C 109.027 -0.731 . . . . 0.21 109.027 178.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.9 t -75.02 -9.38 58.48 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.022 -0.99 . . . . 0.45 109.98 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.519 ' HG2' ' HB3' ' A' ' 58' ' ' ALA . 75.7 ttt180 -79.77 -40.85 27.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.543 -0.753 . . . . 2.91 110.793 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.646 ' HB2' ' HB3' ' A' ' 59' ' ' SER . 4.1 t30 -65.54 13.33 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.557 -0.292 . . . . 1.88 111.657 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.492 ' H ' ' C ' ' A' ' 52' ' ' ARG . 47.2 t -100.87 -19.37 15.96 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.085 0.469 . . . . 2.2 110.684 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.512 ' O ' ' HB3' ' A' ' 56' ' ' GLN . 23.4 tt0 -109.97 -0.78 18.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.636 -0.711 . . . . 3.68 109.823 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.512 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 1.0 OUTLIER 164.0 136.32 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.046 -0.979 . . . . 4.31 108.96 -179.251 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 66.0 mtm -41.89 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.617 0.246 . . . . 3.85 110.667 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.519 ' HB3' ' HG2' ' A' ' 52' ' ' ARG . . . -160.4 71.76 0.46 Allowed 'General case' 0 C--O 1.231 0.129 0 N-CA-C 113.053 0.76 . . . . 1.92 113.053 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.646 ' HB3' ' HB2' ' A' ' 53' ' ' ASN . 51.4 p -165.22 -46.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.348 0.499 . . . . 2.28 112.348 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 t-80 -48.74 -27.51 2.98 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.237 -0.585 . . . . 1.3 110.866 -177.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.2 p -97.12 -33.79 11.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.978 0.418 . . . . 1.58 110.713 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.49 -55.06 4.93 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.491 0.923 . . . . 0.33 113.491 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.548 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -64.85 -32.23 57.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 120.716 -0.394 . . . . 0.21 110.834 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -70.76 -58.4 3.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.453 -0.339 . . . . 0.24 111.192 178.623 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -58.59 -44.67 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.385 0.612 . . . . 2.32 110.343 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.89 -26.51 63.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.343 -0.984 . . . . 0.29 108.343 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.89 -46.64 91.08 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 114.835 -1.075 . . . . 0.4 112.488 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -64.99 -42.91 94.1 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.881 0.372 . . . . 0.83 110.826 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -58.09 -39.04 77.59 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.924 -0.58 . . . . 0.53 110.777 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.759 HD22 HD21 ' A' ' 46' ' ' LEU . 10.6 tp -66.63 -50.58 62.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 1.41 111.337 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.46 ' CD1' ' HB2' ' A' ' 98' ' ' GLU . 15.1 t80 -54.76 -35.75 64.11 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.083 -0.71 . . . . 0.75 109.083 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 t -67.14 -41.96 85.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.999 -1.0 . . . . 1.13 111.848 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.4 -43.31 81.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 119.918 -0.713 . . . . 0.28 110.47 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.483 ' HG ' ' HZ ' ' A' ' 90' ' ' PHE . 1.1 m -62.79 -22.89 66.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.9 109.972 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.432 HG12 ' N ' ' A' ' 76' ' ' SER . 1.2 t -75.17 -45.72 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.576 -0.738 . . . . 0.43 111.03 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.432 ' N ' HG12 ' A' ' 75' ' ' VAL . 49.1 m -83.87 -3.32 57.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 0.9 110.665 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -96.38 -32.21 12.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.811 -0.631 . . . . 0.25 111.326 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.4 m -67.86 -6.06 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.048 0.451 . . . . 0.98 111.674 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -79.6 8.46 6.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.119 -0.491 . . . . 1.31 110.084 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 t -127.64 -5.16 5.84 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.853 -0.612 . . . . 1.49 111.054 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.68 HG13 ' HG3' ' A' ' 87' ' ' LYS . 28.9 mm -31.75 -66.02 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.079 0 N-CA-C 112.417 0.525 . . . . 1.39 112.417 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.563 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 77.49 -43.88 0.42 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.263 0.838 . . . . 2.55 113.263 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.591 ' HB3' ' OD1' ' A' ' 86' ' ' ASN . 5.4 mt-30 -50.33 -26.39 4.8 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.039 0.755 . . . . 2.56 113.039 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.5 ' C ' ' H ' ' A' ' 86' ' ' ASN . 27.6 mtm 74.47 -86.87 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.973 1.101 . . . . 2.71 113.973 177.579 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.403 ' H ' ' HB2' ' A' ' 84' ' ' MET . 15.4 ptm180 -64.75 6.36 0.23 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.963 0.411 . . . . 2.78 111.722 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.591 ' OD1' ' HB3' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -119.39 -12.51 9.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.528 0.68 . . . . 2.49 109.407 -179.794 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.68 ' HG3' HG13 ' A' ' 81' ' ' ILE . 2.2 ttpp -57.8 -47.45 82.54 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.752 -1.113 . . . . 2.28 110.751 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -55.82 -46.17 78.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.484 -0.78 . . . . 2.49 110.75 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 92' ' ' GLU . . . -47.55 -70.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.412 0.523 . . . . 0.35 112.412 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.588 ' CE1' HG22 ' A' ' 131' ' ' ILE . 63.7 t80 -62.47 -43.62 98.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.364 0.505 . . . . 0.28 112.364 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.591 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 8.2 ttp180 -56.02 -62.14 1.91 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.617 -0.265 . . . . 3.34 111.423 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -52.96 -33.1 49.51 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.522 -0.308 . . . . 2.58 110.549 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -59.63 -39.94 85.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.478 0.656 . . . . 0.29 109.703 178.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 90' ' ' PHE . 6.3 mt -64.25 -34.31 68.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.351 -0.84 . . . . 0.24 109.471 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -36.09 82.59 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.882 -1.054 . . . . 0.33 109.308 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.65 -47.63 84.87 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.213 -0.662 . . . . 1.64 109.213 178.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.711 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.74 -39.75 85.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.512 -0.767 . . . . 0.62 109.832 178.452 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.46 ' HB2' ' CD1' ' A' ' 71' ' ' TYR . 8.6 tp10 -57.38 -58.01 10.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.466 -0.788 . . . . 1.87 111.029 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.53 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 52.9 m-80 -61.79 -31.68 71.91 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.717 -0.475 . . . . 2.12 109.717 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.629 ' OD1' HD23 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -63.14 -38.47 91.32 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.699 -0.852 . . . . 0.26 108.699 178.261 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.711 HD21 ' CD1' ' A' ' 97' ' ' LEU . 8.9 mt -67.39 -41.7 84.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.159 -1.052 . . . . 0.58 108.159 177.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.53 ' HD3' ' HA ' ' A' ' 99' ' ' ASN . 71.3 mtp180 -56.27 -38.59 71.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.242 -1.344 . . . . 2.09 111.549 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -89.45 -17.77 28.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.035 -0.529 . . . . 2.32 111.743 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.43 HD11 ' CD2' ' A' ' 121' ' ' PHE . 16.5 tp -86.13 -25.31 25.83 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.935 1.087 . . . . 0.31 113.935 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.631 HE22 ' HB2' ' A' ' 107' ' ' CYS . 0.4 OUTLIER -68.63 162.54 25.72 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.554 -0.458 . . . . 2.04 110.451 -178.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.629 HG23 ' H ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -26.72 -63.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 113.541 0.941 . . . . 1.69 113.541 -178.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.631 ' HB2' HE22 ' A' ' 105' ' ' GLN . 7.5 t 60.02 144.24 0.05 OUTLIER Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 120.81 0.338 . . . . 2.44 111.51 -179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.471 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 42.6 Cg_exo -55.07 -73.99 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.51 2.14 . . . . 3.01 112.564 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -171.63 22.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 4.42 110.731 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -45.71 -34.33 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.53 -0.759 . . . . 5.41 111.869 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.98 131.78 10.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.875 0.369 . . . . 5.83 111.705 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 56.1 26.21 48.77 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.912 -0.586 . . . . 5.16 112.941 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 m 51.48 -99.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 4.55 111.295 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -150.77 -112.16 0.56 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.817 -0.706 . . . . 4.42 112.53 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.75 -169.78 0.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.217 1.944 . . . . 5.57 112.373 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 58.87 61.84 2.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.165 -0.47 . . . . 3.79 111.544 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -167.69 -75.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.435 -0.348 . . . . 2.68 111.397 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.0 t 173.11 119.01 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.91 -0.586 . . . . 2.42 110.814 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 17.9 mm-40 -108.3 82.17 1.59 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.816 -0.629 . . . . 2.35 110.577 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -106.77 92.26 4.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.307 -0.86 . . . . 2.16 109.948 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.467 ' HB2' HG21 ' A' ' 50' ' ' ILE . 1.4 m-30 -94.36 42.56 1.09 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.507 . . . . 0.47 111.448 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.4 m -67.06 -21.54 65.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 1.26 110.363 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.426 ' HB2' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -65.67 -42.14 91.67 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.348 -0.612 . . . . 2.58 109.348 178.864 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.489 HD12 ' O ' ' A' ' 124' ' ' LEU . 2.4 tp -60.79 -26.51 67.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.858 -0.793 . . . . 0.26 108.858 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 tp -70.25 -49.07 53.71 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.232 -0.895 . . . . 1.3 109.933 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -63.19 -36.15 82.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.886 -0.597 . . . . 1.4 110.482 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 131' ' ' ILE . 74.0 m -59.72 -42.56 93.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.833 -0.622 . . . . 1.09 110.729 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 41.8 t -60.32 -53.11 53.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.053 -0.521 . . . . 0.51 111.019 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -50.67 -43.32 57.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 2.69 111.33 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.81 -56.35 22.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 2.1 112.209 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.588 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.34 -55.7 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 121.018 -0.273 . . . . 0.29 111.179 -178.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 56.7 p -55.25 -46.26 76.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.94 0.4 . . . . 1.02 110.405 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.571 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 23.6 t70 -53.51 -21.82 7.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.089 -0.505 . . . . 0.37 111.89 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 70.1 mt -88.34 -48.39 14.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.643 0.609 . . . . 0.26 112.643 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.636 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -59.91 -50.34 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 114.371 1.248 . . . . 0.25 114.371 -177.693 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLN . . . . . 0.699 ' HB2' ' NH2' ' A' ' 137' ' ' ARG . 44.3 mt-30 -44.37 -56.21 4.39 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.134 0.42 . . . . 0.91 112.134 -177.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.699 ' NH2' ' HB2' ' A' ' 136' ' ' GLN . 0.0 OUTLIER -70.19 -37.45 75.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.273 0.559 . . . . 4.06 109.518 178.459 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' A' ' 135' ' ' VAL . 4.9 tp -52.98 -76.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.984 -1.007 . . . . 1.89 110.89 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.541 ' HG3' ' HG ' ' A' ' 138' ' ' LEU . 42.6 mt-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.271 -0.871 . . . . 4.17 110.824 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.689 0.281 . . . . 4.47 110.93 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 53.13 35.53 49.63 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.817 -0.706 . . . . 2.5 112.262 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 43.51 34.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.173 0.435 . . . . 2.01 112.173 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.656 ' HA ' HG11 ' A' ' 38' ' ' VAL . 40.5 mm 64.41 109.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.947 -0.57 . . . . 0.39 112.023 179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.49 ' H ' HG12 ' A' ' 38' ' ' VAL . 81.9 p -126.57 -159.57 0.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.441 -0.799 . . . . 0.36 109.614 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.599 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -74.45 -27.76 60.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.718 -0.475 . . . . 0.99 109.718 178.706 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.55 -47.96 82.26 Favored Glycine 0 N--CA 1.453 -0.188 0 CA-C-N 115.642 -0.708 . . . . 0.15 112.021 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.656 HG11 ' HA ' ' A' ' 34' ' ' ILE . 12.4 p -66.68 -37.69 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.518 0.675 . . . . 1.28 109.366 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.438 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.1 t -63.51 -41.48 92.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.622 -1.172 . . . . 0.17 110.962 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.425 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 31.4 mt -65.23 -51.29 61.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.789 0.328 . . . . 0.21 110.285 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.28 -31.41 32.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.152 0.501 . . . . 0.24 109.765 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.3 m -73.14 -42.41 62.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.415 -0.811 . . . . 0.34 111.093 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.667 HG23 HD11 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -63.01 -35.47 80.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.338 . . . . 0.42 111.184 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -72.95 -53.8 10.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 1.52 111.508 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.58 -47.86 28.35 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.348 -0.387 . . . . 0.28 111.69 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.685 HD21 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -70.67 -39.63 73.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.483 -0.326 . . . . 0.3 110.172 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.442 ' N ' HD12 ' A' ' 46' ' ' LEU . 47.2 t -55.25 -37.98 67.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.23 109.93 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.67 -36.25 78.28 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.661 -0.7 . . . . 1.2 109.717 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.74 77.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.605 -0.517 . . . . 0.28 109.605 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.534 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -71.96 -27.37 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 N-CA-C 108.779 -0.823 . . . . 0.21 108.779 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -83.72 -14.82 50.73 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.18 -0.918 . . . . 0.45 109.696 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -90.78 -18.36 25.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.588 -0.733 . . . . 2.91 111.323 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -83.62 9.59 11.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 1.88 110.504 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.2 p -130.28 -25.06 2.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 2.2 110.884 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -100.58 -18.85 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 3.68 111.129 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -144.95 3.34 1.06 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.362 -0.381 . . . . 4.31 111.676 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 60.7 mtt 52.2 48.45 22.65 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.489 -0.323 . . . . 3.85 110.758 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.33 -89.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 1.92 111.716 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.9 p -176.24 143.58 0.53 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 2.28 111.06 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -72.13 -19.82 61.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.512 . . . . 1.3 109.989 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -78.34 -9.02 59.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.662 -0.699 . . . . 1.58 110.539 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.67 -45.81 23.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.33 110.403 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.534 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -76.19 -27.9 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.718 -0.673 . . . . 0.21 109.974 179.006 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.464 HD21 ' OE1' ' A' ' 105' ' ' GLN . 2.1 tm? -73.9 -52.45 12.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.35 -0.841 . . . . 0.24 110.793 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -60.23 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.484 0.659 . . . . 2.32 109.463 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.99 -27.9 67.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.064 -0.971 . . . . 0.29 108.419 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.78 -47.31 87.48 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.874 -1.057 . . . . 0.4 112.154 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.527 ' HZ1' ' HB2' ' A' ' 101' ' ' LEU . 0.3 OUTLIER -61.46 -38.14 86.14 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.057 0.456 . . . . 0.83 110.098 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -60.22 -46.03 91.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.658 -0.701 . . . . 0.53 110.5 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.685 HD22 HD21 ' A' ' 46' ' ' LEU . 14.4 tp -57.99 -48.41 80.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.766 -0.652 . . . . 1.41 110.689 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.476 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 23.8 t80 -59.22 -34.98 72.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.201 -0.454 . . . . 0.75 110.059 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 t -76.46 -19.33 58.14 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.85 -0.614 . . . . 1.13 112.009 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -84.71 -44.64 13.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.789 -0.819 . . . . 0.28 108.789 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 4.3 m -69.44 -20.33 63.77 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.643 -0.708 . . . . 0.9 109.09 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.476 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.8 OUTLIER -72.96 -45.37 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-N 115.617 -0.719 . . . . 0.43 110.364 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.423 ' N ' HG12 ' A' ' 75' ' ' VAL . 43.7 t -81.17 -11.06 59.52 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 121.064 0.459 . . . . 0.9 110.357 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.481 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -93.57 -29.19 15.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.668 -0.696 . . . . 0.25 110.407 179.713 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.568 HG21 ' HG2' ' A' ' 91' ' ' ARG . 0.3 OUTLIER -62.1 -30.05 47.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.846 -0.615 . . . . 0.98 111.858 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.87 -4.45 20.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.067 0.461 . . . . 1.31 110.297 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -104.87 7.07 34.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.688 -0.687 . . . . 1.49 111.444 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.602 ' HB ' ' HD2' ' A' ' 87' ' ' LYS . 5.5 mm -70.11 95.92 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.868 0.366 . . . . 1.39 110.952 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.612 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.0 OUTLIER -80.91 -26.04 37.08 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.76 -0.83 . . . . 2.55 108.76 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.681 ' HB3' ' OD1' ' A' ' 86' ' ' ASN . 6.9 mm-40 -37.63 -41.65 0.49 Allowed 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.201 -1.363 . . . . 2.56 113.9 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.612 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 19.1 mmt 82.09 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.856 1.058 . . . . 2.71 113.856 178.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -71.74 29.92 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.976 0.417 . . . . 2.78 111.3 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.681 ' OD1' ' HB3' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -138.8 -23.94 0.93 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.891 -0.595 . . . . 2.49 110.795 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 5.4 mtmt -39.13 -54.52 1.74 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.859 -0.61 . . . . 2.28 111.045 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.405 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 88.5 m-85 -55.34 -48.94 73.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.534 -0.757 . . . . 2.49 111.453 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.435 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -47.03 -69.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.909 0.337 . . . . 0.35 111.909 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.592 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 t80 -60.05 -44.55 94.61 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.184 0.438 . . . . 0.28 112.184 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.626 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -55.1 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.585 0.231 . . . . 3.34 111.387 -178.337 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 12.1 pt-20 -50.82 -36.74 38.88 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.333 -0.394 . . . . 2.58 110.235 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -59.11 -39.63 82.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.125 0.488 . . . . 0.29 109.822 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 90' ' ' PHE . 9.1 mt -62.97 -38.97 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.24 109.396 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.481 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 0.1 OUTLIER -57.57 -43.62 84.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.834 -1.075 . . . . 0.33 110.045 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -50.36 71.86 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.336 -0.393 . . . . 1.64 110.264 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.785 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -54.93 -41.62 71.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.816 -0.629 . . . . 0.62 109.804 178.76 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 95' ' ' ASN . 7.8 tp10 -57.1 -59.97 4.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.443 -0.799 . . . . 1.87 110.881 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -66.72 -9.33 35.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 2.12 110.227 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.557 ' OD1' HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -85.13 -37.73 19.89 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.516 -1.29 . . . . 0.26 107.516 178.773 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.785 HD21 ' CD1' ' A' ' 97' ' ' LEU . 7.6 mt -67.75 -39.88 84.16 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.416 -1.327 . . . . 0.58 107.416 177.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.612 ' O ' ' HB2' ' A' ' 105' ' ' GLN . 75.1 mtt180 -55.9 -53.52 55.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.293 -1.321 . . . . 2.09 110.686 178.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -68.93 -23.89 64.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.709 -0.478 . . . . 2.32 109.709 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.402 HD23 HD23 ' A' ' 64' ' ' LEU . 38.6 tp -76.13 -17.54 59.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.621 -0.718 . . . . 0.31 110.339 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.612 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 0.3 OUTLIER -50.98 166.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.68 -0.691 . . . . 2.04 110.398 179.252 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.491 HG23 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -43.14 -49.99 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.589 -0.278 . . . . 1.69 111.285 -179.54 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.491 ' N ' HG23 ' A' ' 106' ' ' ILE . 33.8 t 62.23 137.39 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-O 121.617 0.722 . . . . 2.44 112.222 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.447 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 43.2 Cg_endo -76.68 -80.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 123.671 2.914 . . . . 3.01 112.806 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.493 ' HB1' ' O ' ' A' ' 112' ' ' GLY . . . -177.66 14.71 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.815 -1.084 . . . . 4.42 108.944 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.545 ' O ' HG22 ' A' ' 110' ' ' THR . 18.0 m 21.92 77.58 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.329 -1.305 . . . . 5.41 112.146 -177.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 61.06 103.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.934 -1.03 . . . . 5.83 111.734 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . 0.493 ' O ' ' HB1' ' A' ' 109' ' ' ALA . . . 62.53 -130.28 43.24 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.922 -0.656 . . . . 5.16 112.863 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.6 t -167.97 -169.64 1.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.687 0.279 . . . . 4.55 110.495 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -158.12 -95.17 0.11 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.823 -0.703 . . . . 4.42 111.639 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' A' ' 116' ' ' ALA . 25.8 Cg_exo -61.95 -67.99 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 121.815 1.677 . . . . 5.57 110.953 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 115' ' ' PRO . . . 170.12 -70.78 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.63 -0.714 . . . . 3.79 110.696 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -145.46 -59.66 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 2.68 110.783 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.7 p 55.92 110.97 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.367 0.603 . . . . 2.42 111.573 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -124.22 82.77 2.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.442 -0.799 . . . . 2.35 111.071 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -139.08 81.63 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.452 -0.794 . . . . 2.16 108.916 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.483 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.7 OUTLIER -79.48 53.13 1.49 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.497 -0.774 . . . . 0.47 112.176 -177.902 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 88.6 p -75.68 -16.7 60.14 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.737 -0.468 . . . . 1.26 109.737 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.433 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 3.4 mppt? -69.9 -41.91 74.08 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.049 -0.722 . . . . 2.58 109.049 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.557 HD13 ' OD1' ' A' ' 100' ' ' ASN . 1.3 tp -61.63 -25.31 67.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.575 -0.898 . . . . 0.26 108.575 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.29 -48.7 49.1 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.007 -0.997 . . . . 1.3 109.925 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 50.7 m -63.43 -35.75 81.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.754 -0.657 . . . . 1.4 110.51 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 131' ' ' ILE . 39.9 t -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 1.09 110.74 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.601 HG22 HG22 ' A' ' 43' ' ' THR . 17.9 t -60.87 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 0.51 111.124 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -54.57 -38.28 66.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.577 -0.738 . . . . 2.69 112.073 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -60.86 -56.17 24.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.474 0.546 . . . . 2.1 112.474 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.592 HG22 ' CE2' ' A' ' 90' ' ' PHE . 1.3 mt -52.68 -54.15 17.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 121.078 0.466 . . . . 0.29 110.811 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.5 t -53.45 -47.91 69.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.762 -0.653 . . . . 1.02 111.18 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.403 ' C ' HH21 ' A' ' 137' ' ' ARG . 17.0 t70 -58.16 -25.81 61.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.37 111.626 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.597 HG22 HD13 ' A' ' 138' ' ' LEU . 78.1 mt -73.33 -51.88 23.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.039 0.385 . . . . 0.26 112.039 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.599 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -62.19 -35.94 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.309 0.485 . . . . 0.25 112.309 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.34 -60.34 3.07 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.981 -0.288 . . . . 0.91 111.231 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.492 ' NE ' ' HA ' ' A' ' 134' ' ' ILE . 0.0 OUTLIER -67.84 -12.37 60.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.179 0.514 . . . . 4.06 110.114 179.402 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.597 HD13 HG22 ' A' ' 134' ' ' ILE . 5.2 tp -52.14 -81.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.535 -0.757 . . . . 1.89 111.122 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.65 -0.69 . . . . 4.17 111.169 179.988 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 95.9 p . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 120.662 0.268 . . . . 4.47 111.408 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.49 -41.21 98.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.235 -0.983 . . . . 2.5 111.258 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.01 12.72 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 2.01 109.718 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.788 ' HA ' HG11 ' A' ' 38' ' ' VAL . 37.1 mm -141.92 90.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.411 -0.813 . . . . 0.39 111.091 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.609 ' O ' HG12 ' A' ' 38' ' ' VAL . 73.9 p -125.65 -158.98 0.87 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.766 -0.828 . . . . 0.36 108.766 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.564 ' HB2' HG21 ' A' ' 135' ' ' VAL . 6.1 ttpt -66.5 -35.93 81.48 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.91 -0.716 . . . . 0.99 109.141 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.21 -49.37 63.78 Favored Glycine 0 N--CA 1.452 -0.237 0 CA-C-N 114.989 -1.005 . . . . 0.15 113.005 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.788 HG11 ' HA ' ' A' ' 34' ' ' ILE . 9.7 p -65.26 -37.81 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.205 0 CA-C-O 121.467 0.651 . . . . 1.28 109.866 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.486 ' O ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -65.03 -36.31 77.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 114.671 -1.15 . . . . 0.17 111.08 -179.753 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.468 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 26.8 mt -71.13 -51.54 24.41 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.916 -0.314 . . . . 0.21 110.548 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -54.04 -34.18 59.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.24 109.801 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.623 ' CB ' HD23 ' A' ' 70' ' ' LEU . 65.9 m -73.62 -44.16 57.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.401 -0.818 . . . . 0.34 111.179 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.67 HG23 HD21 ' A' ' 70' ' ' LEU . 0.8 OUTLIER -64.25 -31.44 72.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.986 0.422 . . . . 0.42 110.566 178.622 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -72.46 -54.94 7.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.826 -0.625 . . . . 1.52 111.06 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.79 -47.33 20.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.115 -0.493 . . . . 0.28 111.382 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.466 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.1 pp -72.11 -38.83 69.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.827 -0.349 . . . . 0.3 110.355 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.453 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.4 t -55.35 -37.65 67.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.23 110.249 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.96 -38.82 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.923 -0.58 . . . . 1.2 110.0 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.38 -46.3 76.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.717 -0.475 . . . . 0.28 109.717 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.615 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -62.3 -39.74 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.817 -0.809 . . . . 0.21 108.817 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.0 t -61.43 -17.04 52.47 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.585 -0.895 . . . . 0.45 108.585 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.454 ' O ' ' N ' ' A' ' 54' ' ' SER . 42.3 mtt180 -106.38 -106.62 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.854 -1.066 . . . . 2.91 110.923 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.59 ' ND2' ' HA ' ' A' ' 50' ' ' ILE . 55.1 m-20 41.35 18.86 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.036 0.446 . . . . 1.88 111.834 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.454 ' N ' ' O ' ' A' ' 52' ' ' ARG . 46.9 m -152.13 -16.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.771 -0.65 . . . . 2.2 109.895 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -61.94 -26.56 68.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.594 -0.73 . . . . 3.68 110.333 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.528 ' HG2' ' N ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -172.86 -58.29 0.02 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.217 -0.447 . . . . 4.31 111.087 179.46 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.528 ' N ' ' HG2' ' A' ' 56' ' ' GLN . 59.0 mtt -146.04 -113.49 0.09 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.406 -0.361 . . . . 3.85 110.15 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.453 ' O ' ' HB3' ' A' ' 59' ' ' SER . . . 72.57 -47.75 0.67 Allowed 'General case' 0 CA--C 1.518 -0.283 0 O-C-N 123.339 0.4 . . . . 1.92 112.0 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 58' ' ' ALA . 6.2 t 64.91 164.36 0.15 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.823 0.345 . . . . 2.28 111.664 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 -63.54 -18.06 63.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.466 -0.568 . . . . 1.3 109.466 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.8 m -70.88 -8.25 51.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.473 -0.785 . . . . 1.58 110.335 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -47.17 15.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.155 0.502 . . . . 0.33 109.996 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.615 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.98 -28.79 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.449 -0.796 . . . . 0.21 109.775 178.832 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.556 HD23 HD23 ' A' ' 104' ' ' LEU . 1.0 OUTLIER -73.86 -51.49 16.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.132 -0.94 . . . . 0.24 111.015 179.002 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.48 -50.72 70.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.242 0.544 . . . . 2.32 109.723 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.74 -26.91 67.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.375 -0.972 . . . . 0.29 108.375 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.452 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -64.14 -46.48 90.97 Favored Glycine 0 N--CA 1.442 -0.906 0 CA-C-N 114.865 -1.061 . . . . 0.4 112.324 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.18 -41.83 99.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.74 0.305 . . . . 0.83 110.687 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.477 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.7 m-80 -58.42 -40.46 82.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.53 110.995 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.67 HD21 HG23 ' A' ' 43' ' ' THR . 2.6 tm? -65.35 -50.47 65.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 1.41 110.865 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.447 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 12.6 t80 -56.44 -29.86 62.15 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.375 -0.972 . . . . 0.75 108.375 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 32.8 t -67.73 -53.35 28.16 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.927 -1.033 . . . . 1.13 111.112 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.03 -43.62 95.18 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.306 -0.558 . . . . 0.28 111.715 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -52.09 67.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.927 0.394 . . . . 0.9 110.904 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.45 -33.92 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.43 112.871 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.5 t -90.92 -13.36 33.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.038 0.447 . . . . 0.9 110.794 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.487 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -88.24 -24.2 23.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.684 -0.689 . . . . 0.25 111.379 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.7 m -69.8 -12.89 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.98 111.374 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -68.59 -5.64 21.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 1.31 110.355 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.8 m -118.36 6.89 11.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.854 -0.612 . . . . 1.49 111.449 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.845 HG23 HD22 ' A' ' 86' ' ' ASN . 1.0 OUTLIER -47.68 -24.95 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.211 0.448 . . . . 1.39 112.211 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.408 ' OE1' ' C ' ' A' ' 82' ' ' GLN . 5.5 tm0? 64.32 -70.38 0.08 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.144 0.497 . . . . 2.55 110.276 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.495 ' HB3' ' OD1' ' A' ' 86' ' ' ASN . 6.7 mm-40 -51.8 173.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.122 -0.945 . . . . 2.56 109.801 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.42 -20.22 0.85 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.46 -0.496 . . . . 2.71 111.418 -178.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -95.34 15.86 18.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.857 -0.794 . . . . 2.78 108.857 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.845 HD22 HG23 ' A' ' 81' ' ' ILE . 12.7 p-10 -128.87 -30.88 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.863 -1.062 . . . . 2.49 110.863 -179.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.65 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 11.1 tttm -42.37 -52.23 4.64 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.878 -0.601 . . . . 2.28 111.916 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -55.04 -45.89 75.28 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.846 -0.341 . . . . 2.49 110.827 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -50.58 -71.0 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.914 0.387 . . . . 0.35 111.987 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.583 ' CE1' HG22 ' A' ' 131' ' ' ILE . 71.4 t80 -61.37 -46.02 91.92 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.476 0.547 . . . . 0.28 112.476 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.65 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -56.48 -57.96 10.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.536 0.207 . . . . 3.34 111.235 -178.084 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.7 pt-20 -50.3 -37.64 37.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.4 -0.364 . . . . 2.58 110.165 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.0 -41.66 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.38 0.61 . . . . 0.29 109.569 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.576 HD11 ' CE2' ' A' ' 90' ' ' PHE . 17.8 mt -62.48 -42.97 97.78 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.433 -0.803 . . . . 0.24 109.328 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.7 -38.9 70.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.86 -1.064 . . . . 0.33 109.371 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 1.1 mptm? -57.17 -46.98 82.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.978 -0.556 . . . . 1.64 109.956 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.588 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 33.2 tp -58.96 -36.15 74.34 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 120.956 0.408 . . . . 0.62 110.147 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.7 OUTLIER -57.24 -59.08 5.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.871 -0.604 . . . . 1.87 110.169 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 34.1 m-80 -71.31 -10.06 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.853 -0.612 . . . . 2.12 111.032 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.478 ' HB3' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.47 -47.95 14.75 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 108.58 -0.896 . . . . 0.26 108.58 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 7.5 mt -64.44 -33.86 76.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.393 -0.966 . . . . 0.58 108.393 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 81.4 mtt180 -55.04 -55.68 28.3 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 114.944 -1.025 . . . . 2.09 110.899 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -73.1 -19.69 61.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.022 0.439 . . . . 2.32 110.47 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.556 HD23 HD23 ' A' ' 64' ' ' LEU . 51.6 tp -76.27 -16.94 59.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.769 -0.65 . . . . 0.31 111.286 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.482 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -52.03 167.45 0.12 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.374 -0.376 . . . . 2.04 111.232 -179.773 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.512 HG23 ' H ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -56.83 -56.48 14.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.21 -0.45 . . . . 1.69 111.429 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.512 ' H ' HG23 ' A' ' 106' ' ' ILE . 6.7 t 59.93 143.92 0.05 OUTLIER Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 120.946 0.403 . . . . 2.44 111.844 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.47 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 52.3 Cg_exo -53.14 -73.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.683 2.255 . . . . 3.01 112.879 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -148.94 -13.73 0.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 4.42 111.297 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.7 m -54.54 -27.56 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.254 -0.43 . . . . 5.41 111.182 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -50.42 73.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 5.83 111.188 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 166.66 74.28 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 5.16 112.659 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.2 t -96.77 110.88 23.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.674 0.273 . . . . 4.55 111.081 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -167.76 -94.67 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.56 -0.828 . . . . 4.42 112.755 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.16 -46.56 32.0 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.337 2.025 . . . . 5.57 112.296 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -166.71 -65.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 3.79 111.072 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -161.74 -40.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 2.68 111.3 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 73.0 p 51.61 106.42 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.295 0.569 . . . . 2.42 111.686 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -134.2 85.94 2.23 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.518 -0.765 . . . . 2.35 111.314 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -119.54 89.53 3.15 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.541 -1.208 . . . . 2.16 109.188 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.467 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -93.3 42.55 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.025 -0.534 . . . . 0.47 112.027 -178.109 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 80.2 p -69.75 -17.05 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.676 -0.41 . . . . 1.26 110.014 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -48.21 68.13 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.651 -0.87 . . . . 2.58 108.651 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.522 HD12 ' O ' ' A' ' 124' ' ' LEU . 1.5 tp -54.24 -25.76 24.98 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.214 -0.903 . . . . 0.26 109.251 177.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.78 -48.41 54.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.328 -0.851 . . . . 1.3 110.247 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.5 p -66.85 -35.04 79.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.126 -0.488 . . . . 1.4 111.116 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 26.0 t -62.77 -42.53 99.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 1.09 111.302 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 124' ' ' LEU . 42.6 t -63.14 -50.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.113 -0.494 . . . . 0.51 110.852 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -53.19 -37.65 62.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.89 -0.595 . . . . 2.69 110.548 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.415 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.5 tt0 -60.46 -56.43 21.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.712 -0.677 . . . . 2.1 112.32 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.583 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -52.62 -55.74 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.95 0.405 . . . . 0.29 111.187 -178.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 7.5 t -54.13 -45.57 71.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.61 . . . . 1.02 111.353 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.45 -26.06 64.9 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.151 0.426 . . . . 0.37 112.151 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.508 ' O ' ' HB2' ' A' ' 138' ' ' LEU . 81.3 mt -75.5 -52.51 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 112.041 0.386 . . . . 0.26 112.041 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.564 HG21 ' HB2' ' A' ' 36' ' ' LYS . 1.4 p -59.67 -37.45 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 112.537 0.569 . . . . 0.25 112.537 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLN . . . . . 0.581 ' C ' ' HE ' ' A' ' 137' ' ' ARG . 27.1 mt-30 -70.06 -56.29 7.29 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.75 -0.38 . . . . 0.91 110.711 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.609 ' HE ' ' CA ' ' A' ' 137' ' ' ARG . 0.1 OUTLIER -87.02 51.62 2.3 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 122.267 1.032 . . . . 4.06 109.688 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.615 HD21 HD21 ' A' ' 86' ' ' ASN . 1.9 tp -117.07 -78.73 0.58 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.382 -1.735 . . . . 1.89 110.762 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.57 -0.729 . . . . 4.17 111.776 179.864 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 38.5 p . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.704 0.288 . . . . 4.47 111.015 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 54.47 47.35 69.86 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.742 -0.742 . . . . 2.5 112.118 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 45.89 26.97 0.43 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.894 0.378 . . . . 2.01 111.914 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.659 ' HA ' HG11 ' A' ' 38' ' ' VAL . 44.2 mm 64.32 108.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.671 -0.695 . . . . 0.39 112.215 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.518 ' O ' HG12 ' A' ' 38' ' ' VAL . 81.9 p -123.08 -160.46 0.9 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.266 -0.879 . . . . 0.36 109.09 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.666 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.28 -30.52 60.46 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.177 -0.609 . . . . 0.99 109.408 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.83 -47.61 89.61 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.418 -0.81 . . . . 0.15 111.827 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.659 HG11 ' HA ' ' A' ' 34' ' ' ILE . 13.9 p -67.09 -37.97 80.32 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-O 121.455 0.645 . . . . 1.28 109.34 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.442 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.7 t -60.52 -42.79 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 114.747 -1.115 . . . . 0.17 111.17 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.455 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.0 mt -67.11 -51.51 53.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.243 -0.28 . . . . 0.21 110.243 178.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -52.78 -30.94 35.84 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.178 -0.675 . . . . 0.24 109.178 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.503 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 66.2 m -73.16 -52.67 13.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.177 -0.92 . . . . 0.34 110.664 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.66 HG23 HD21 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -55.62 -29.37 59.05 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.88 0.371 . . . . 0.42 110.87 178.429 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -75.07 -51.86 12.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.102 -0.499 . . . . 1.52 110.661 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.23 -46.78 35.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.97 -0.559 . . . . 0.28 110.992 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 50' ' ' ILE . 3.9 pp -72.71 -40.66 65.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.325 -0.398 . . . . 0.3 110.173 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.458 ' N ' HD12 ' A' ' 46' ' ' LEU . 44.0 t -54.15 -36.21 63.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.089 0.471 . . . . 0.23 110.001 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.78 -34.49 64.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 1.2 109.793 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.02 -36.13 76.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.487 -0.56 . . . . 0.28 109.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.545 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -72.81 -32.3 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 N-CA-C 108.496 -0.927 . . . . 0.21 108.496 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -76.97 -15.29 59.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.118 -0.946 . . . . 0.45 109.389 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -87.71 -15.32 37.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.512 -0.767 . . . . 2.91 110.934 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.501 HD22 ' N ' ' A' ' 59' ' ' SER . 5.9 t-20 -101.43 4.54 41.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 1.88 110.453 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 52.8 m -112.63 -37.06 5.02 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.137 -0.483 . . . . 2.2 111.418 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -105.33 -3.56 22.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.068 0.461 . . . . 3.68 110.547 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 -144.99 -148.7 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.599 -0.728 . . . . 4.31 109.662 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.8 66.86 1.36 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.885 0.374 . . . . 3.85 110.758 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.32 -98.73 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.066 -0.515 . . . . 1.92 110.91 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.501 ' N ' HD22 ' A' ' 53' ' ' ASN . 88.8 p -178.66 140.82 0.19 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.746 0.308 . . . . 2.28 111.051 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -71.44 -18.54 62.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.094 0.473 . . . . 1.3 109.744 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 48.2 t -78.8 -10.94 59.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.66 -0.7 . . . . 1.58 110.325 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.25 -46.18 23.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.582 . . . . 0.33 110.341 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.545 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -71.29 -25.71 25.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.21 109.235 178.534 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.544 HD21 ' OE1' ' A' ' 105' ' ' GLN . 1.7 tm? -75.63 -48.5 21.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.879 -1.055 . . . . 0.24 110.425 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -61.35 -52.23 65.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.609 0.718 . . . . 2.32 109.272 179.017 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.04 -26.84 67.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.588 -1.187 . . . . 0.29 108.448 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.86 -49.21 69.59 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.06 -0.973 . . . . 0.4 112.478 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HZ1' ' HB2' ' A' ' 101' ' ' LEU . 1.0 OUTLIER -60.72 -43.72 97.52 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.864 0.364 . . . . 0.83 110.399 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 73' ' ' PHE . 17.6 m-80 -58.39 -42.19 86.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.878 -0.601 . . . . 0.53 110.777 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.66 HD21 HG23 ' A' ' 43' ' ' THR . 1.1 tm? -58.5 -48.66 80.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 1.41 110.223 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.474 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 47.8 t80 -60.62 -33.29 72.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.75 110.914 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.4 p -80.76 -16.77 52.96 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.207 0.447 . . . . 1.13 112.207 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 69' ' ' ASN . 24.3 m-85 -80.28 -44.29 19.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.506 -0.924 . . . . 0.28 108.506 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 78' ' ' VAL . 7.8 m -70.93 -27.4 63.74 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.337 -0.847 . . . . 0.9 109.15 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -64.57 -38.32 82.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-N 115.618 -0.719 . . . . 0.43 110.95 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.8 t -91.27 -11.71 37.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.922 0.392 . . . . 0.9 110.44 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.472 ' HB2' HG22 ' A' ' 34' ' ' ILE . 1.2 t80 -90.7 -26.58 19.48 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.919 -0.582 . . . . 0.25 111.929 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.498 HG11 ' HG2' ' A' ' 91' ' ' ARG . 2.8 m -63.06 -10.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 121.125 0.488 . . . . 0.98 111.044 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.0 6.67 3.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.958 -0.565 . . . . 1.31 110.598 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 41.1 t -126.66 -1.17 6.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.039 -0.528 . . . . 1.49 111.106 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.777 HG23 HD22 ' A' ' 86' ' ' ASN . 18.3 mm -40.74 -30.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 112.444 0.535 . . . . 1.39 112.444 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? 61.57 -72.36 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 123.767 0.667 . . . . 2.55 109.863 -178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.562 ' HB3' ' CG ' ' A' ' 86' ' ' ASN . 1.4 tm0? -49.02 156.5 0.51 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.256 -1.016 . . . . 2.56 108.256 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.4 ptm -122.48 -34.66 3.22 Favored 'General case' 0 C--N 1.314 -0.957 0 C-N-CA 120.019 -0.672 . . . . 2.71 112.723 -177.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -86.02 27.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.315 -0.624 . . . . 2.78 109.315 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.777 HD22 HG23 ' A' ' 81' ' ' ILE . 5.2 p-10 -132.11 -29.47 1.63 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.9 -1.046 . . . . 2.49 110.77 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 7.8 mttt -39.69 -50.19 2.3 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.731 -0.668 . . . . 2.28 111.519 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -56.39 -48.74 76.27 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.238 -0.437 . . . . 2.49 110.455 -179.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.09 -68.37 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.046 0.388 . . . . 0.35 112.046 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.731 ' CE2' HD11 ' A' ' 94' ' ' ILE . 89.5 t80 -66.43 -50.23 64.09 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.429 0.899 . . . . 0.28 113.429 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.625 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -58.55 -47.86 82.81 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.339 -0.144 . . . . 3.34 111.308 -176.73 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 6.5 pt-20 -58.9 -37.88 77.61 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.651 -0.5 . . . . 2.58 109.651 178.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.18 -41.28 88.11 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.172 -0.677 . . . . 0.29 109.172 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.731 HD11 ' CE2' ' A' ' 90' ' ' PHE . 40.4 mt -60.19 -42.75 91.39 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.289 -0.869 . . . . 0.24 109.039 178.397 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.48 ' OD1' ' HD2' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -58.53 -44.79 89.69 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 114.556 -1.202 . . . . 0.33 109.666 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.48 ' HD2' ' OD1' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -48.44 -45.82 36.92 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.093 0.473 . . . . 1.64 109.783 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.802 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -60.63 -40.75 93.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.76 . . . . 0.62 110.055 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -55.29 -61.29 2.43 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.707 -0.679 . . . . 1.87 111.627 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.442 ' ND2' ' O ' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -60.42 -35.44 75.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.907 -0.405 . . . . 2.12 109.907 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.56 ' OD1' HD23 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -58.93 -34.58 71.9 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.895 -0.779 . . . . 0.26 108.895 177.434 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.802 HD21 ' CD1' ' A' ' 97' ' ' LEU . 10.9 mt -71.06 -41.65 70.45 Favored 'General case' 0 C--N 1.34 0.171 0 N-CA-C 108.307 -0.997 . . . . 0.58 108.307 177.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 90.8 mtt180 -54.21 -47.85 71.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.693 -1.14 . . . . 2.09 111.478 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -79.01 -23.99 43.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.862 0.363 . . . . 2.32 110.66 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.3 tp -73.66 -15.8 61.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.31 111.334 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.544 ' OE1' HD21 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -51.26 163.36 0.25 Allowed 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 116.386 -0.37 . . . . 2.04 110.912 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.549 HD13 ' O ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -58.27 -50.91 76.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.374 -0.376 . . . . 1.69 111.022 -179.549 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' CYS . . . . . 0.549 ' O ' HD13 ' A' ' 106' ' ' ILE . 35.5 t 61.59 141.17 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.271 0 CA-C-N 116.395 -0.366 . . . . 2.44 111.462 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.475 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 31.9 Cg_exo -58.7 -77.6 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.503 2.135 . . . . 3.01 112.41 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.51 ' HA ' ' HB3' ' A' ' 113' ' ' SER . . . -176.2 20.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.415 -0.357 . . . . 4.42 111.2 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 m -48.32 -50.94 28.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.955 -0.566 . . . . 5.41 111.351 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.59 33.36 0.7 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 5.83 111.168 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.06 88.9 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.831 -0.699 . . . . 5.16 112.508 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.51 ' HB3' ' HA ' ' A' ' 109' ' ' ALA . 41.1 t -129.81 105.19 7.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 4.55 111.19 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -156.8 -83.34 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.814 -0.708 . . . . 4.42 112.268 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.0 161.64 43.0 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.3 2.0 . . . . 5.57 111.954 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 57.99 -169.91 0.11 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.305 -0.407 . . . . 3.79 111.203 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -123.71 -55.26 1.72 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.264 -0.425 . . . . 2.68 110.849 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.4 p 43.65 87.05 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.351 0.596 . . . . 2.42 110.794 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -145.65 84.8 1.68 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.217 -0.901 . . . . 2.35 112.489 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -114.2 86.8 2.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 2.16 109.376 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.427 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 1.6 m-30 -83.05 43.72 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.47 112.021 -178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 89.7 p -67.93 -15.93 63.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 1.26 110.085 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -69.97 -36.65 75.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.13 -0.693 . . . . 2.58 109.13 178.866 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 124' ' ' LEU . 0.3 OUTLIER -65.6 -23.81 66.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.441 -0.948 . . . . 0.26 108.441 178.21 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.37 -48.62 32.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.877 -1.056 . . . . 1.3 110.309 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.2 t -66.59 -34.78 78.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.84 -0.618 . . . . 1.4 110.86 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 131' ' ' ILE . 67.5 m -62.44 -45.7 91.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.941 -0.572 . . . . 1.09 111.157 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 124' ' ' LEU . 46.1 t -60.52 -54.86 29.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.51 111.51 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -50.51 -38.94 47.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.96 -0.563 . . . . 2.69 111.39 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.09 -56.02 23.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.971 -0.558 . . . . 2.1 112.46 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.703 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -52.36 -55.31 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.681 0.277 . . . . 0.29 111.13 -178.743 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 54.4 p -53.73 -47.42 70.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 1.02 111.004 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -53.01 -29.58 30.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.38 -0.373 . . . . 0.37 111.752 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.485 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 65.9 mt -79.3 -51.42 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.837 0.68 . . . . 0.26 112.837 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.666 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -57.57 -45.55 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.518 0.562 . . . . 0.25 112.518 -178.709 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -49.29 -49.19 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.465 -0.334 . . . . 0.91 111.737 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.485 ' NH2' ' HA ' ' A' ' 134' ' ' ILE . 0.0 OUTLIER -78.28 -15.18 59.01 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.615 -0.513 . . . . 4.06 109.615 178.95 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.608 ' HG ' HD21 ' A' ' 86' ' ' ASN . 0.5 OUTLIER -81.38 -79.19 0.17 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.47 -0.786 . . . . 1.89 110.622 179.636 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.416 ' N ' HD13 ' A' ' 138' ' ' LEU . 43.3 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.245 -0.883 . . . . 4.17 110.956 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.475 HG22 ' HB2' ' A' ' 77' ' ' TYR . 49.6 mm . . . . . 0 N--CA 1.457 -0.115 0 CA-C-O 121.185 0.517 . . . . 0.39000000000000001 111.918 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.4 p -131.75 -172.44 2.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.35999999999999999 109.898 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.634 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -66.08 -33.55 76.04 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.541 -0.464 . . . . 0.98999999999999999 110.073 179.404 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.402 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.78 -45.9 94.77 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 0.14999999999999999 111.316 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.4 t -67.91 -39.97 82.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.657 0.741 . . . . 1.28 109.525 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -43.28 95.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.619 -1.173 . . . . 0.17000000000000001 110.852 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.483 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 23.8 mt -60.98 -48.8 80.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.763 0.316 . . . . 0.20999999999999999 110.543 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.69 -33.25 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.23999999999999999 110.366 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.808 ' CB ' HD23 ' A' ' 70' ' ' LEU . 46.0 m -76.87 -35.41 57.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.34000000000000002 111.47 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.483 ' OG1' ' HA ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -71.8 -33.39 68.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.971 0.415 . . . . 0.41999999999999998 110.838 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -77.22 -48.88 16.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.02 -0.536 . . . . 1.52 110.776 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.93 -46.99 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.139 -0.482 . . . . 0.28000000000000003 110.974 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.525 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.91 -38.44 79.58 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.306 -0.406 . . . . 0.29999999999999999 110.247 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.525 ' N ' HD12 ' A' ' 46' ' ' LEU . 7.8 t -55.52 -35.68 65.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.004 0.431 . . . . 0.23000000000000001 109.847 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.18 -34.21 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.826 -0.624 . . . . 1.2 109.834 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.32 -35.4 73.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.232 -0.655 . . . . 0.28000000000000003 109.232 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.524 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.5 mt -72.11 -33.71 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.701 -0.852 . . . . 0.20999999999999999 108.701 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -74.37 -12.82 60.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.041 -0.982 . . . . 0.45000000000000001 109.6 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 . . . . . 0 N--CA 1.456 -0.172 0 CA-C-N 115.364 -0.834 . . . . 2.9100000000000001 110.98 -179.992 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 . . . . . 0 N--CA 1.457 -0.077 0 N-CA-C 109.887 -0.412 . . . . 1.3 109.887 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.5 m -76.9 -3.22 37.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.754 -0.657 . . . . 1.5800000000000001 110.848 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.73 -53.73 5.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.094 0.473 . . . . 0.33000000000000002 109.891 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.524 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -69.64 -28.97 39.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.20999999999999999 109.701 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.634 HD21 ' NE2' ' A' ' 105' ' ' GLN . 0.6 OUTLIER -72.23 -53.42 12.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.841 -1.072 . . . . 0.23999999999999999 110.98 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.37 -49.37 78.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.302 0.572 . . . . 2.3199999999999998 109.894 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.24 -27.32 67.12 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.368 -0.975 . . . . 0.28999999999999998 108.368 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.437 ' HA3' HD22 ' A' ' 101' ' ' LEU . . . -61.75 -47.54 89.71 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.746 -1.116 . . . . 0.40000000000000002 112.582 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.438 ' HD2' HD13 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -65.81 -41.36 91.97 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.574 0.226 . . . . 0.82999999999999996 111.224 -179.535 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.419 ' O ' ' HB2' ' A' ' 72' ' ' SER . 19.7 m-80 -58.42 -43.16 88.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.91 0.386 . . . . 0.53000000000000003 110.953 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.808 HD23 ' CB ' ' A' ' 42' ' ' SER . 3.2 tm? -64.7 -50.21 67.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.977 -0.556 . . . . 1.4099999999999999 111.133 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.41 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 7.2 t80 -56.52 -33.27 65.88 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.679 -0.86 . . . . 0.75 108.679 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 70.6 m -65.17 -50.6 65.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.012 -0.994 . . . . 1.1299999999999999 111.001 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.455 ' HB3' HG23 ' A' ' 34' ' ' ILE . 11.5 m-85 -62.17 -43.64 98.39 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.363 -0.535 . . . . 0.28000000000000003 111.639 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -51.19 70.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.263 -0.426 . . . . 0.90000000000000002 110.896 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.36 -37.79 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 112.527 0.566 . . . . 0.42999999999999999 112.527 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -86.4 -10.27 54.64 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.056 0.455 . . . . 0.90000000000000002 110.866 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.475 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -91.91 -23.55 19.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.787 -0.642 . . . . 0.25 111.778 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.0 OUTLIER -72.81 -11.44 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.949 0.404 . . . . 0.97999999999999998 111.574 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -71.9 -3.61 23.47 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 1.3100000000000001 109.681 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -110.64 1.97 18.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.45 -0.795 . . . . 1.49 111.459 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.621 HG21 ' HB2' ' A' ' 87' ' ' LYS . 23.3 mm -66.31 115.78 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 120.528 -0.469 . . . . 1.3899999999999999 110.172 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.551 ' O ' ' HG3' ' A' ' 84' ' ' MET . 0.2 OUTLIER -84.67 -29.11 25.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 121.087 0.47 . . . . 2.5499999999999998 110.099 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.687 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 15.0 mm100 -46.52 -47.08 19.55 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.26 -0.882 . . . . 2.5600000000000001 113.101 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.551 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 43.3 mtm 81.91 -91.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.763 0.653 . . . . 2.71 112.763 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -64.75 0.92 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.886 0.374 . . . . 2.7799999999999998 111.736 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.687 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -114.61 -17.97 11.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.067 -0.716 . . . . 2.4900000000000002 109.067 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.621 ' HB2' HG21 ' A' ' 81' ' ' ILE . 0.6 OUTLIER -58.77 -35.65 73.11 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.173 -0.921 . . . . 2.2799999999999998 109.289 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.463 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 71.1 m-85 -56.98 -44.25 82.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.574 -0.739 . . . . 2.4900000000000002 110.026 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -53.77 -61.82 2.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 0.34999999999999998 112.085 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.654 ' CE2' HD11 ' A' ' 94' ' ' ILE . 66.9 t80 -63.23 -45.59 90.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.28000000000000003 111.559 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.595 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.2 OUTLIER -58.15 -52.44 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 3.3399999999999999 111.723 -178.139 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 11.0 pt-20 -54.94 -36.46 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.192 -0.299 . . . . 2.5800000000000001 110.192 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.06 -40.03 88.09 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.665 0.745 . . . . 0.28999999999999998 109.123 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.654 HD11 ' CE2' ' A' ' 90' ' ' PHE . 32.9 mt -61.81 -41.2 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.174 -0.921 . . . . 0.23999999999999999 109.018 178.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.685 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.51 -39.11 79.18 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.589 -1.187 . . . . 0.33000000000000002 109.292 179.422 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.685 ' HD2' HD22 ' A' ' 95' ' ' ASN . 1.3 mptm? -54.4 -47.5 72.67 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.752 -0.462 . . . . 1.6399999999999999 109.752 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.724 ' CD2' HD12 ' A' ' 70' ' ' LEU . 33.7 tp -59.95 -32.27 70.64 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.631 -0.427 . . . . 0.62 110.197 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -58.64 -60.14 4.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.144 -0.48 . . . . 1.8700000000000001 110.736 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.441 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 0.9 OUTLIER -73.57 -10.22 59.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 2.1200000000000001 111.474 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.499 ' ND2' HD12 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.9 -47.86 19.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.723 -0.843 . . . . 0.26000000000000001 108.723 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 8.2 mt -66.42 -31.92 72.97 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.234 -0.894 . . . . 0.57999999999999996 108.659 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.441 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 87.1 mtt180 -54.69 -55.76 26.41 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.092 -0.958 . . . . 2.0899999999999999 110.764 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -71.89 -18.99 62.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.979 0.418 . . . . 2.3199999999999998 110.495 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.497 HD11 ' CE2' ' A' ' 121' ' ' PHE . 32.9 tp -79.53 -18.18 52.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.941 -0.572 . . . . 0.31 111.225 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.634 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.217 0 CA-C-N 116.483 -0.326 . . . . 2.04 111.322 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.497 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.5 m-30 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.733 0.272 . . . . 0.46999999999999997 111.733 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . 0.548 ' HB2' ' HZ1' ' A' ' 123' ' ' LYS . 31.0 m -71.64 -14.28 62.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.938 -0.305 . . . . 1.26 110.605 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.548 ' HZ1' ' HB2' ' A' ' 122' ' ' SER . 0.1 OUTLIER -69.64 -44.21 71.06 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.198 -0.668 . . . . 2.5800000000000001 109.198 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.526 ' O ' HD12 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -59.61 -25.44 64.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.376 -0.829 . . . . 0.26000000000000001 108.771 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tp -73.88 -48.19 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.134 -0.939 . . . . 1.3 110.636 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.5 t -63.91 -35.82 81.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.131 -0.486 . . . . 1.3999999999999999 111.123 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 131' ' ' ILE . 65.6 m -65.58 -46.74 78.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.541 . . . . 1.0900000000000001 111.91 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.45 HG13 ' HB ' ' A' ' 43' ' ' THR . 55.3 t -62.89 -55.43 23.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 0.51000000000000001 111.537 -178.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -50.61 -40.68 53.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.764 -0.653 . . . . 2.6899999999999999 111.017 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.5 -55.31 36.64 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.837 -0.62 . . . . 2.1000000000000001 112.061 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.583 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.24 -56.14 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 120.735 0.303 . . . . 0.28999999999999998 111.157 -178.857 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 30.7 t -56.61 -47.6 79.27 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.262 -0.426 . . . . 1.02 110.758 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -50.18 -26.73 4.91 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.922 -0.581 . . . . 0.37 112.28 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.1 mt -86.29 -51.21 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 113.131 0.789 . . . . 0.26000000000000001 113.131 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.634 HG21 ' HG3' ' A' ' 36' ' ' LYS . 1.4 p -53.98 -47.56 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 113.897 1.073 . . . . 0.25 113.897 -177.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 . . . . . 0 C--N 1.326 -0.453 0 C-N-CA 120.636 -0.426 . . . . 0.91000000000000003 111.709 -178.363 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.69 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.4 mm . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 121.241 0.543 . . . . 0.39000000000000001 111.814 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.532 ' O ' HG12 ' A' ' 38' ' ' VAL . 81.2 p -123.45 -160.27 0.9 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.427 -0.806 . . . . 0.35999999999999999 109.179 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.652 ' HB2' HG21 ' A' ' 135' ' ' VAL . 6.5 ttpt -69.78 -39.97 76.3 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.206 -0.597 . . . . 0.98999999999999999 109.426 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -52.18 -49.6 49.5 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.251 -0.886 . . . . 0.14999999999999999 112.861 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.69 HG11 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -65.82 -38.67 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.606 0.717 . . . . 1.28 109.565 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.428 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.3 t -62.64 -38.11 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.578 -1.192 . . . . 0.17000000000000001 111.181 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.0 mt -68.18 -51.41 46.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.062 -0.347 . . . . 0.20999999999999999 110.062 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.48 -31.02 21.97 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.315 -0.624 . . . . 0.23999999999999999 109.315 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.2 m -73.96 -44.33 55.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.301 -0.863 . . . . 0.34000000000000002 110.7 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.849 HG22 HG22 ' A' ' 128' ' ' VAL . 3.6 p -60.2 -37.7 81.04 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 120.865 0.364 . . . . 0.41999999999999998 111.049 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.46 -52.91 27.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 1.52 111.29 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.12 -47.11 34.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.28000000000000003 111.572 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.794 HD21 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -74.91 -40.26 60.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.45 -0.341 . . . . 0.29999999999999999 110.742 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.437 ' N ' HD12 ' A' ' 46' ' ' LEU . 44.1 t -55.46 -39.96 71.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.048 0.451 . . . . 0.23000000000000001 110.276 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -70.3 -35.01 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 1.2 109.948 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.04 81.38 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.702 -0.481 . . . . 0.28000000000000003 109.702 178.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.632 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.0 mt -70.72 -30.18 41.04 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 N-CA-C 108.785 -0.82 . . . . 0.20999999999999999 108.785 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -79.15 -13.8 59.5 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.117 -0.947 . . . . 0.45000000000000001 109.649 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.375 -0.829 . . . . 2.9100000000000001 111.439 -179.612 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 109.861 -0.422 . . . . 1.3 109.861 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -78.08 -10.88 59.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.729 -0.669 . . . . 1.5800000000000001 110.27 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.28 -45.94 24.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.33000000000000002 110.206 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.632 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.13 -29.55 21.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.20999999999999999 109.896 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.677 HD23 HD23 ' A' ' 104' ' ' LEU . 1.2 tm? -74.35 -51.24 15.67 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.992 -1.004 . . . . 0.23999999999999999 111.18 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.31 -49.47 71.62 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.154 0.502 . . . . 2.3199999999999998 109.799 179.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.96 -27.41 67.44 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.258 -1.015 . . . . 0.28999999999999998 108.258 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -65.08 -46.42 88.63 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.795 -1.093 . . . . 0.40000000000000002 112.253 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.28 -43.94 98.04 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.847 0.356 . . . . 0.82999999999999996 110.559 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -58.44 -41.95 86.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.53000000000000003 111.033 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.794 HD22 HD21 ' A' ' 46' ' ' LEU . 12.9 tp -61.52 -47.69 84.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.2 -0.455 . . . . 1.4099999999999999 110.432 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.592 ' HB2' HD23 ' A' ' 97' ' ' LEU . 10.5 t80 -57.94 -35.42 71.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.933 -0.576 . . . . 0.75 110.228 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 53.1 p -80.23 -18.62 48.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 1.1299999999999999 112.399 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -80.31 -44.44 19.55 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.326 -0.99 . . . . 0.28000000000000003 108.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 77' ' ' TYR . 3.8 m -68.99 -27.08 65.37 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.502 -0.772 . . . . 0.90000000000000002 109.118 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.475 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.5 OUTLIER -66.14 -37.78 80.51 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.615 -0.721 . . . . 0.42999999999999999 110.801 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.5 t -91.06 -9.66 44.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.996 0.426 . . . . 0.90000000000000002 110.07 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.503 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -90.77 -28.35 18.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.634 -0.712 . . . . 0.25 111.454 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.44 ' HA ' HG12 ' A' ' 81' ' ' ILE . 3.4 m -66.1 -11.39 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.96 0.409 . . . . 0.97999999999999998 111.663 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -71.05 -2.9 17.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 1.3100000000000001 110.811 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 57.4 p -119.19 3.56 11.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.977 -0.556 . . . . 1.49 111.924 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.683 HG22 HD21 ' A' ' 86' ' ' ASN . 11.9 mm -55.22 -33.06 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 111.956 0.354 . . . . 1.3899999999999999 111.956 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.492 ' NE2' ' C ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 61.96 -66.65 0.07 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.565 0.95 . . . . 2.5499999999999998 113.565 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.515 ' O ' ' N ' ' A' ' 85' ' ' ARG . 9.5 mt-30 -46.03 -9.33 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.97 1.1 . . . . 2.5600000000000001 113.97 -177.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.546 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 7.5 ptt? 48.43 -69.92 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.566 1.321 . . . . 2.71 114.566 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 83' ' ' GLN . 34.0 ttm180 -48.97 -40.87 32.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.568 0.622 . . . . 2.7799999999999998 110.729 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.683 HD21 HG22 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -73.3 -28.2 61.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.692 -0.686 . . . . 2.4900000000000002 110.631 179.237 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.602 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -56.72 -37.05 70.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.027 -0.533 . . . . 2.2799999999999998 111.021 -179.336 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -57.03 -48.5 78.35 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.578 -0.449 . . . . 2.4900000000000002 110.067 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.91 -65.6 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.955 -0.566 . . . . 0.34999999999999998 111.875 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.594 ' CE1' HG22 ' A' ' 131' ' ' ILE . 68.0 t80 -62.83 -47.4 83.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.535 0.569 . . . . 0.28000000000000003 112.535 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.602 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.8 OUTLIER -57.99 -56.52 20.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.686 -0.233 . . . . 3.3399999999999999 111.32 -177.446 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.7 pt-20 -52.38 -36.18 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.886 -0.413 . . . . 2.5800000000000001 109.886 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -61.45 -38.91 88.92 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.366 -0.605 . . . . 0.28999999999999998 109.366 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.573 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -62.26 -40.93 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 N-CA-C 108.724 -0.843 . . . . 0.23999999999999999 108.724 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.658 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.65 -42.53 88.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.444 -1.253 . . . . 0.33000000000000002 109.225 179.238 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.658 ' HD2' HD22 ' A' ' 95' ' ' ASN . 1.1 mptm? -52.92 -40.94 63.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.501 -0.555 . . . . 1.6399999999999999 109.501 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.593 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 15.5 tp -65.3 -35.79 82.07 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.888 -0.596 . . . . 0.62 110.238 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -53.63 -61.37 2.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.076 0.465 . . . . 1.8700000000000001 110.383 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.463 ' H ' ' ND2' ' A' ' 99' ' ' ASN . 0.4 OUTLIER -63.35 -40.62 97.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.669 -0.696 . . . . 2.1200000000000001 111.156 179.054 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.537 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -49.45 -45.56 46.8 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.957 0.408 . . . . 0.26000000000000001 110.051 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 4.8 mt -68.27 -39.55 82.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.792 -0.64 . . . . 0.57999999999999996 109.537 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 47.0 mtp180 -54.59 -48.48 72.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.237 -0.892 . . . . 2.0899999999999999 111.307 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.84 -21.35 55.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.087 0.47 . . . . 2.3199999999999998 110.19 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.677 HD23 HD23 ' A' ' 64' ' ' LEU . 22.2 tp -77.79 -11.92 59.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.632 -0.713 . . . . 0.31 110.916 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.646 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 116.049 -0.523 . . . . 2.04 111.146 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.436 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 111.871 0.323 . . . . 0.46999999999999997 111.871 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 58.7 m -66.45 -15.26 63.2 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.837 -0.345 . . . . 1.26 110.221 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.437 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.41 -40.11 67.42 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.123 -0.695 . . . . 2.5800000000000001 109.123 178.752 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.514 ' O ' HD12 ' A' ' 124' ' ' LEU . 1.7 tp -65.5 -15.97 63.2 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.895 -0.78 . . . . 0.26000000000000001 108.895 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.81 -48.18 13.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.173 -0.922 . . . . 1.3 110.15 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.9 p -73.54 -29.36 62.4 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 1.3999999999999999 110.741 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.0 t -69.32 -49.13 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.883 -0.599 . . . . 1.0900000000000001 110.691 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.849 HG22 HG22 ' A' ' 43' ' ' THR . 0.3 OUTLIER -61.25 -42.15 92.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 115.372 -0.831 . . . . 0.51000000000000001 110.832 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -64.35 -33.9 76.9 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.878 -0.601 . . . . 2.6899999999999999 110.404 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -59.59 -46.53 88.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.761 -0.654 . . . . 2.1000000000000001 110.751 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.594 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.5 OUTLIER -57.25 -55.65 19.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.923 0.392 . . . . 0.28999999999999998 110.464 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 135' ' ' VAL . 1.4 t -53.68 -42.74 68.27 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.911 -0.586 . . . . 1.02 110.809 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.77 -37.89 77.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.998 -0.546 . . . . 0.37 112.066 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 72.8 mt -64.46 -53.1 46.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 112.057 0.392 . . . . 0.26000000000000001 112.057 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.652 HG21 ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.05 -40.8 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 N-CA-C 112.793 0.664 . . . . 0.25 112.793 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 111.935 0.346 . . . . 0.91000000000000003 111.935 -178.832 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.681 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.1 mm . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.335 0.588 . . . . 0.39000000000000001 112.152 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.525 ' O ' HG12 ' A' ' 38' ' ' VAL . 72.0 p -124.02 -160.35 0.92 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.319 -0.855 . . . . 0.35999999999999999 109.342 178.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.626 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -75.5 -27.14 58.67 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.467 -0.568 . . . . 0.98999999999999999 109.467 178.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.64 -46.58 93.43 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.46 -0.791 . . . . 0.14999999999999999 111.832 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.681 HG11 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -68.88 -36.03 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.688 0.756 . . . . 1.28 109.29 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.403 HG22 ' SG ' ' A' ' 74' ' ' CYS . 1.5 t -63.26 -43.66 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.467 -1.242 . . . . 0.17000000000000001 110.764 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.498 HD12 ' HE3' ' A' ' 36' ' ' LYS . 26.4 mt -61.73 -51.12 69.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.798 0.332 . . . . 0.20999999999999999 110.254 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -54.64 -30.09 54.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.23999999999999999 110.166 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.793 ' HB2' HD23 ' A' ' 70' ' ' LEU . 70.2 m -79.38 -36.79 38.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.624 -0.716 . . . . 0.34000000000000002 111.456 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.568 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -71.33 -26.93 63.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.177 0.513 . . . . 0.41999999999999998 109.802 178.698 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -80.85 -45.74 16.39 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.592 -0.731 . . . . 1.52 109.956 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.91 -47.26 52.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.928 -0.578 . . . . 0.28000000000000003 111.043 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.565 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -72.66 -39.28 67.25 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.726 -0.39 . . . . 0.29999999999999999 110.056 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.565 ' N ' HD12 ' A' ' 46' ' ' LEU . 51.9 t -54.2 -42.25 69.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.128 -0.487 . . . . 0.23000000000000001 110.276 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -38.4 81.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.77 -0.65 . . . . 1.2 109.682 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . -57.25 -28.97 63.42 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.28000000000000003 109.803 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -75.88 -39.37 37.78 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 108.888 -0.782 . . . . 0.20999999999999999 108.888 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t -73.13 -10.04 59.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.273 -0.876 . . . . 0.45000000000000001 109.595 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 21.0 mmt180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.159 -0.928 . . . . 2.9100000000000001 110.437 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 121.09 0.471 . . . . 1.3 109.755 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -75.08 -10.4 59.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.618 -0.719 . . . . 1.5800000000000001 110.473 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.92 -48.41 14.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.044 -0.526 . . . . 0.33000000000000002 110.098 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.463 ' CG2' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -73.17 -35.79 48.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.277 -0.638 . . . . 0.20999999999999999 109.277 178.441 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.659 HD21 ' NE2' ' A' ' 105' ' ' GLN . 2.0 tm? -64.15 -54.9 26.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.037 -0.983 . . . . 0.23999999999999999 110.689 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.08 -48.88 78.23 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.258 -0.428 . . . . 2.3199999999999998 111.726 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.2 -25.1 65.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.066 -0.516 . . . . 0.28999999999999998 110.893 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.559 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -83.55 -30.15 30.78 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.176 -1.011 . . . . 0.40000000000000002 112.402 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.77 ' HD2' HD13 ' A' ' 101' ' ' LEU . 15.7 mmmt -63.99 -35.23 80.01 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.977 -1.12 . . . . 0.82999999999999996 107.977 177.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -70.0 -43.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.479 -1.237 . . . . 0.53000000000000003 109.9 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.854 HD12 HD22 ' A' ' 97' ' ' LEU . 3.4 tm? -59.08 -48.1 82.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.298 -0.864 . . . . 1.4099999999999999 110.147 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.555 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 10.7 t80 -61.14 -33.25 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.908 -0.587 . . . . 0.75 109.64 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 t -73.29 -26.85 61.24 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.673 -0.694 . . . . 1.1299999999999999 112.03 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -81.61 -43.55 18.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 119.725 -0.79 . . . . 0.28000000000000003 109.452 -178.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.403 ' SG ' HG22 ' A' ' 39' ' ' VAL . 15.4 m -64.31 -43.8 93.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.704 -0.68 . . . . 0.90000000000000002 109.672 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.93 -39.75 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.955 -0.566 . . . . 0.42999999999999999 111.995 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.4 t -86.73 -11.21 51.78 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.997 -0.681 . . . . 0.90000000000000002 110.441 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.522 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.6 OUTLIER -90.68 -23.96 20.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.755 -0.657 . . . . 0.25 112.146 -179.395 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.49 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.6 m -70.28 -8.4 10.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.182 0.515 . . . . 0.97999999999999998 111.221 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -74.77 -0.99 20.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.861 -0.609 . . . . 1.3100000000000001 110.357 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 80.2 p -114.05 4.79 15.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.962 -0.563 . . . . 1.49 111.325 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.607 HG21 ' HB2' ' A' ' 87' ' ' LYS . 25.0 mm -70.4 92.88 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 116.474 -0.33 . . . . 1.3899999999999999 111.197 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.555 HE21 ' HA ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -59.81 -34.76 73.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.781 -0.822 . . . . 2.5499999999999998 108.781 178.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.626 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 1.6 mp0 -60.82 172.14 1.02 Allowed 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 114.905 -1.043 . . . . 2.5600000000000001 109.969 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 4.9 ptm -144.06 -43.77 0.26 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.326 -0.397 . . . . 2.71 111.335 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -81.99 9.69 7.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.665 0.745 . . . . 2.7799999999999998 109.045 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.626 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -126.89 -32.51 2.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.587 -1.188 . . . . 2.4900000000000002 110.041 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.607 ' HB2' HG21 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -50.65 -44.63 57.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.387 -0.824 . . . . 2.2799999999999998 111.067 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.522 ' N ' ' HD2' ' A' ' 87' ' ' LYS . 2.2 p90 -56.89 -46.8 81.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.4 0.619 . . . . 2.4900000000000002 110.219 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -52.77 -59.7 4.17 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.949 -1.023 . . . . 0.34999999999999998 112.193 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.622 ' CE1' HG22 ' A' ' 131' ' ' ILE . 68.8 t80 -66.13 -48.09 71.96 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.263 0.468 . . . . 0.28000000000000003 112.263 -179.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.516 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.5 OUTLIER -56.61 -52.92 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.462 -0.335 . . . . 3.3399999999999999 110.795 -177.728 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.5 pt-20 -55.52 -36.87 67.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 2.5800000000000001 110.382 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.2 -39.25 85.88 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.433 0.635 . . . . 0.28999999999999998 109.731 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.604 HD11 ' CE2' ' A' ' 90' ' ' PHE . 21.2 mt -62.63 -40.97 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.404 0 CA-C-N 115.357 -0.838 . . . . 0.23999999999999999 108.806 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.603 ' ND2' ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.51 -40.83 83.97 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.497 -1.229 . . . . 0.33000000000000002 109.186 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.603 ' HD2' ' ND2' ' A' ' 95' ' ' ASN . 11.0 mptt -51.95 -49.89 62.26 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.374 -0.375 . . . . 1.6399999999999999 110.133 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.854 HD22 HD12 ' A' ' 70' ' ' LEU . 30.7 tp -58.44 -32.25 68.53 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 116.079 -0.51 . . . . 0.62 110.606 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.59 -60.08 4.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.373 -0.376 . . . . 1.8700000000000001 110.495 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.438 ' ND2' ' H ' ' A' ' 99' ' ' ASN . 0.8 OUTLIER -72.59 -10.04 59.31 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.119 -0.491 . . . . 2.1200000000000001 111.587 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.492 ' ND2' HD12 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.72 -43.95 21.68 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.37 -0.974 . . . . 0.26000000000000001 108.37 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.77 HD13 ' HD2' ' A' ' 68' ' ' LYS . 10.5 mt -68.11 -33.19 74.05 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.053 -0.976 . . . . 0.57999999999999996 108.45 178.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -54.95 -55.55 29.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.854 -1.066 . . . . 2.0899999999999999 110.534 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -71.76 -21.95 61.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.001 0.429 . . . . 2.3199999999999998 110.575 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.627 HD23 HD23 ' A' ' 64' ' ' LEU . 29.3 tp -77.77 -17.99 56.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.31 111.339 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.659 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.322 -0.399 . . . . 2.04 111.234 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.517 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.162 0 N-CA-C 111.951 0.352 . . . . 0.46999999999999997 111.951 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 43.9 m -66.82 -15.91 63.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.917 -0.401 . . . . 1.26 109.917 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.452 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 3.0 mppt? -70.89 -44.38 66.42 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.715 -0.846 . . . . 2.5800000000000001 108.715 178.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.496 ' O ' HD12 ' A' ' 124' ' ' LEU . 1.4 tp -60.23 -22.1 62.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.463 -0.789 . . . . 0.26000000000000001 108.945 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -48.81 29.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.258 -0.883 . . . . 1.3 109.872 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.1 m -67.12 -31.68 72.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.703 -0.681 . . . . 1.3999999999999999 110.667 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.473 ' O ' HG13 ' A' ' 131' ' ' ILE . 68.6 m -66.98 -41.73 86.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 1.0900000000000001 111.218 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.568 HG13 ' HB ' ' A' ' 43' ' ' THR . 26.2 t -63.42 -56.16 18.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.13 -0.486 . . . . 0.51000000000000001 111.074 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.0 mmtt -52.67 -36.48 57.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.56 -0.746 . . . . 2.6899999999999999 111.341 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.408 ' O ' HG13 ' A' ' 134' ' ' ILE . 40.3 tt0 -62.5 -51.61 66.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.106 -0.497 . . . . 2.1000000000000001 112.278 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.622 HG22 ' CE1' ' A' ' 90' ' ' PHE . 1.3 mt -55.23 -55.23 17.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 C-N-CA 120.942 -0.303 . . . . 0.28999999999999998 110.96 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.1 p -55.21 -45.77 75.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 1.02 111.275 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.79 -31.29 58.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.37 111.739 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.491 HG21 ' N ' ' A' ' 90' ' ' PHE . 91.1 mt -74.78 -51.25 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 112.877 0.695 . . . . 0.26000000000000001 112.877 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.626 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.57 -41.62 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 112.296 0.48 . . . . 0.25 112.296 -179.056 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.309 -0.405 . . . . 0.91000000000000003 111.848 -178.852 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.633 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.0 mm . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 121.361 0.601 . . . . 0.39000000000000001 112.065 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.551 ' O ' HG12 ' A' ' 38' ' ' VAL . 77.5 p -129.55 -159.42 0.96 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.291 -0.868 . . . . 0.35999999999999999 109.483 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.685 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.3 -30.86 60.49 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.384 -0.527 . . . . 0.98999999999999999 109.733 178.463 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -60.85 -46.14 95.12 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.539 -0.755 . . . . 0.14999999999999999 112.046 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.633 HG11 ' HA ' ' A' ' 34' ' ' ILE . 10.8 p -66.97 -39.3 83.14 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 1.28 109.522 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.446 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -63.23 -43.38 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 114.825 -1.079 . . . . 0.17000000000000001 110.876 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.473 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.2 mt -63.11 -46.85 85.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.71 0.29 . . . . 0.20999999999999999 110.521 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.9 -32.63 67.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.966 0.412 . . . . 0.23999999999999999 110.224 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.803 ' CB ' HD23 ' A' ' 70' ' ' LEU . 39.3 m -77.47 -35.45 53.79 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.747 -0.661 . . . . 0.34000000000000002 111.371 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.478 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.3 OUTLIER -73.31 -26.6 61.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.509 . . . . 0.41999999999999998 109.816 178.545 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -79.11 -47.26 16.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.509 -0.769 . . . . 1.52 110.161 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.51 -47.29 63.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.054 -0.521 . . . . 0.28000000000000003 111.024 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.616 HD22 ' HA2' ' A' ' 67' ' ' GLY . 4.2 pp -69.97 -40.28 75.48 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.821 -0.352 . . . . 0.29999999999999999 110.182 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.549 ' N ' HD12 ' A' ' 46' ' ' LEU . 53.9 t -57.31 -41.69 80.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.043 -0.526 . . . . 0.23000000000000001 110.889 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mp -65.88 -39.86 91.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 1.2 110.238 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.84 -39.65 71.71 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.78 -0.452 . . . . 0.28000000000000003 109.78 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -70.12 -38.5 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.228 0 N-CA-C 108.902 -0.777 . . . . 0.20999999999999999 108.902 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -71.14 -14.55 62.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.45000000000000001 109.18 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-N 115.266 -0.879 . . . . 2.9100000000000001 111.137 -179.944 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.954 0.407 . . . . 1.3 110.013 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -77.61 -5.11 49.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 1.5800000000000001 111.17 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.97 -48.98 10.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.973 0.416 . . . . 0.33000000000000002 110.515 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.531 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -68.05 -39.48 81.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.826 -0.624 . . . . 0.20999999999999999 110.258 179.334 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 104' ' ' LEU . 1.1 tm? -65.02 -56.06 15.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.442 -0.799 . . . . 0.23999999999999999 111.224 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.14 -44.04 95.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.342 -0.39 . . . . 2.3199999999999998 111.596 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.63 -45.71 85.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.041 -0.527 . . . . 0.28999999999999998 111.063 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.616 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -62.87 -31.36 80.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.335 -0.936 . . . . 0.40000000000000002 112.578 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -44.31 96.14 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.464 -0.939 . . . . 0.82999999999999996 108.464 177.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -62.68 -38.63 91.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.61 -1.177 . . . . 0.53000000000000003 110.341 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.803 HD23 ' CB ' ' A' ' 42' ' ' SER . 2.8 tm? -65.77 -49.97 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.472 -0.785 . . . . 1.4099999999999999 111.069 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -53.6 -34.88 59.99 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.735 -0.839 . . . . 0.75 108.735 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.0 m -68.46 -49.67 58.14 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.042 -0.981 . . . . 1.1299999999999999 111.444 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -57.25 -43.57 83.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.92 -0.712 . . . . 0.28000000000000003 110.581 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.457 ' O ' HG13 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -60.74 -29.33 69.31 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.766 -0.652 . . . . 0.90000000000000002 109.838 178.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -37.13 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.489 -0.778 . . . . 0.42999999999999999 111.36 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.3 t -89.59 -9.03 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.90000000000000002 110.977 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.523 ' HB2' HG22 ' A' ' 34' ' ' ILE . 1.6 t80 -94.63 -29.6 14.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.0 -0.545 . . . . 0.25 111.614 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.475 ' O ' HG12 ' A' ' 81' ' ' ILE . 3.6 m -61.65 -11.92 6.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.148 0.499 . . . . 0.97999999999999998 111.034 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -80.19 8.67 6.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.769 -0.65 . . . . 1.3100000000000001 109.877 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 58.5 m -117.53 -8.99 10.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.694 -0.685 . . . . 1.49 110.693 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.56 HG21 ' HG3' ' A' ' 87' ' ' LYS . 34.6 mm -56.91 106.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 116.106 -0.497 . . . . 1.3899999999999999 110.869 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.684 HE21 ' C ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER -67.93 -48.39 66.09 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.936 0.398 . . . . 2.5499999999999998 110.133 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.58 ' HB2' ' ND2' ' A' ' 86' ' ' ASN . 28.7 mt-30 -59.31 -174.55 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.77 -0.65 . . . . 2.5600000000000001 109.955 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -152.46 -40.34 0.11 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.349 -0.54 . . . . 2.71 111.582 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -73.78 -1.9 21.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.642 0.734 . . . . 2.7799999999999998 109.052 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.588 ' ND2' ' N ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -115.65 -25.57 7.79 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.943 -1.026 . . . . 2.4900000000000002 110.611 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.588 ' N ' ' ND2' ' A' ' 86' ' ' ASN . 1.0 OUTLIER -45.47 -48.93 13.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.798 -0.637 . . . . 2.2799999999999998 111.083 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -56.2 -43.0 78.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.793 -0.64 . . . . 2.4900000000000002 110.75 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -55.24 -61.24 2.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.271 0.471 . . . . 0.34999999999999998 112.271 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.651 ' CE2' HD11 ' A' ' 94' ' ' ILE . 88.9 t80 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.195 0.442 . . . . 0.28000000000000003 112.195 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.06 -55.03 31.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 3.3399999999999999 110.654 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.4 pt-20 -58.55 -34.3 70.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 2.5800000000000001 110.564 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -59.99 -37.99 81.29 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.494 0.664 . . . . 0.28999999999999998 109.823 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.651 HD11 ' CE2' ' A' ' 90' ' ' PHE . 11.0 mt -66.11 -36.22 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 115.336 -0.847 . . . . 0.23999999999999999 109.123 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.688 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -61.74 -32.09 72.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.86 -1.063 . . . . 0.33000000000000002 109.22 179.115 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.688 ' HD2' HD22 ' A' ' 95' ' ' ASN . 0.7 OUTLIER -63.89 -48.67 75.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.526 -0.546 . . . . 1.6399999999999999 109.526 178.581 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.743 ' CD2' HD12 ' A' ' 70' ' ' LEU . 23.5 tp -58.11 -33.59 69.29 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 116.165 -0.47 . . . . 0.62 109.951 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.494 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 7.5 tp10 -57.75 -59.24 5.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.892 -0.594 . . . . 1.8700000000000001 110.424 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.566 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 29.3 m-80 -72.75 -9.93 59.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 2.1200000000000001 111.181 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.65 ' ND2' HD13 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -78.41 -47.94 16.51 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 108.683 -0.858 . . . . 0.26000000000000001 108.683 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 5.9 mt -65.5 -34.44 78.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.323 -0.991 . . . . 0.57999999999999996 108.323 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.566 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 98.2 mtt180 -55.49 -50.03 70.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.942 -1.026 . . . . 2.0899999999999999 111.256 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.75 -22.13 50.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.106 0.479 . . . . 2.3199999999999998 110.136 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 64' ' ' LEU . 42.0 tp -69.37 -17.31 63.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.721 -0.672 . . . . 0.31 110.83 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.648 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.168 0 CA-C-O 120.769 0.319 . . . . 2.04 110.517 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.468 ' HB2' HG21 ' A' ' 50' ' ' ILE . 2.0 m-30 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 112.234 0.457 . . . . 0.46999999999999997 112.234 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 96.4 p -73.18 -17.15 61.4 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.702 -0.481 . . . . 1.26 109.702 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 123' ' ' LYS . 29.8 mmmt -66.83 -52.61 41.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 109.135 -0.691 . . . . 2.5800000000000001 109.135 178.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.65 HD13 ' ND2' ' A' ' 100' ' ' ASN . 0.8 OUTLIER -51.41 -27.04 9.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.001 -0.999 . . . . 0.26000000000000001 109.049 177.544 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.46 -49.71 38.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.266 -0.879 . . . . 1.3 110.214 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 89.7 p -64.43 -34.26 77.78 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.903 -0.59 . . . . 1.3999999999999999 111.128 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 t -62.31 -46.88 86.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 1.0900000000000001 111.529 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.478 HG13 ' HB ' ' A' ' 43' ' ' THR . 53.8 t -60.87 -50.23 81.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.51000000000000001 111.311 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -50.71 -43.82 57.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.035 -0.53 . . . . 2.6899999999999999 110.92 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.414 ' O ' HG13 ' A' ' 134' ' ' ILE . 10.9 tp10 -59.26 -55.47 34.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.638 -0.71 . . . . 2.1000000000000001 112.79 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.585 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.0 OUTLIER -51.36 -55.07 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-O 120.826 0.346 . . . . 0.28999999999999998 111.299 -178.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 41.2 t -53.61 -48.4 69.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.11 -0.496 . . . . 1.02 111.048 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.87 -29.84 30.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.103 0.408 . . . . 0.37 112.103 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 130' ' ' GLU . 65.7 mt -76.8 -51.31 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 113.012 0.745 . . . . 0.26000000000000001 113.012 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.685 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -58.03 -44.9 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.536 0.939 . . . . 0.25 113.536 -178.172 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 . . . . . 0 C--N 1.321 -0.637 0 N-CA-C 112.825 0.676 . . . . 0.91000000000000003 112.825 -177.913 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.457 HG22 ' HB2' ' A' ' 77' ' ' TYR . 50.7 mm . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 121.151 0.5 . . . . 0.39000000000000001 111.954 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.7 p -127.95 -175.95 3.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.626 -0.715 . . . . 0.35999999999999999 109.649 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.623 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.74 -34.29 77.83 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.372 -0.531 . . . . 0.98999999999999999 109.775 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.448 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.0 -43.71 98.8 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.676 -0.773 . . . . 0.14999999999999999 111.2 178.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.1 t -69.08 -40.36 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.591 0.71 . . . . 1.28 109.559 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.26 -44.16 97.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.639 -1.164 . . . . 0.17000000000000001 110.826 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.466 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 25.1 mt -60.58 -47.4 86.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.722 0.296 . . . . 0.20999999999999999 110.602 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -56.35 -31.47 63.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.23999999999999999 110.219 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.779 ' CB ' HD23 ' A' ' 70' ' ' LEU . 41.8 m -77.86 -34.85 51.53 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.761 -0.654 . . . . 0.34000000000000002 111.277 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.476 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.2 OUTLIER -73.43 -29.14 62.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.41999999999999998 109.805 178.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -79.23 -45.76 19.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.698 -0.683 . . . . 1.52 110.218 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.61 -47.19 63.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.043 -0.526 . . . . 0.28000000000000003 110.786 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.583 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.24 -39.97 82.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.526 -0.47 . . . . 0.29999999999999999 110.055 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.583 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.9 t -56.85 -41.45 77.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.211 -0.45 . . . . 0.23000000000000001 110.756 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.71 -39.15 90.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 1.2 110.191 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.68 -34.11 69.07 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.408 -0.59 . . . . 0.28000000000000003 109.408 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.585 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -72.17 -30.33 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 109.037 -0.727 . . . . 0.20999999999999999 109.037 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -81.62 -13.16 58.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.158 -0.928 . . . . 0.45000000000000001 109.689 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 115.599 -0.728 . . . . 2.9100000000000001 111.205 -179.766 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' A' ' 105' ' ' GLN . 5.3 p-80 . . . . . 0 N--CA 1.456 -0.156 0 N-CA-C 109.91 -0.404 . . . . 1.3 109.91 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.7 m -64.97 -10.21 27.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.9 -0.591 . . . . 1.5800000000000001 110.48 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.36 -51.46 7.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.917 -0.583 . . . . 0.33000000000000002 110.193 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.585 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -72.13 -34.23 49.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.58 -0.736 . . . . 0.20999999999999999 109.709 178.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' A' ' 105' ' ' GLN . 2.2 tm? -64.87 -53.29 49.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.205 -0.907 . . . . 0.23999999999999999 110.325 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.45 -45.36 91.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.863 -0.608 . . . . 2.3199999999999998 111.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.0 74.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.28999999999999998 111.288 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.556 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -75.88 -30.4 57.72 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.097 -1.049 . . . . 0.40000000000000002 112.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -64.21 -40.3 95.78 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.36 -0.978 . . . . 0.82999999999999996 108.36 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.2 m-80 -65.38 -39.23 91.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.626 -1.17 . . . . 0.53000000000000003 109.918 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.779 HD23 ' CB ' ' A' ' 42' ' ' SER . 3.0 tm? -65.55 -49.82 67.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.312 -0.858 . . . . 1.4099999999999999 110.824 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -56.52 -32.8 65.44 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.28 -1.007 . . . . 0.75 108.28 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 35.0 t -65.04 -50.28 66.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.99 -1.005 . . . . 1.1299999999999999 110.773 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.448 ' HB3' HG23 ' A' ' 34' ' ' ILE . 12.1 m-85 -63.11 -42.94 99.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.525 -0.47 . . . . 0.28000000000000003 111.456 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -50.61 73.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.346 -0.388 . . . . 0.90000000000000002 110.591 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 72' ' ' SER . 0.4 OUTLIER -55.56 -36.68 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.981 -0.554 . . . . 0.42999999999999999 112.384 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.2 t -88.28 -9.89 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.098 0.475 . . . . 0.90000000000000002 110.502 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.457 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -90.14 -27.97 19.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.629 -0.714 . . . . 0.25 111.295 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.2 m -69.24 -10.76 13.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.32 . . . . 0.97999999999999998 111.422 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.96 -2.43 18.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.126 0.489 . . . . 1.3100000000000001 110.021 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.4 t -111.61 -0.43 16.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.79 -0.641 . . . . 1.49 111.291 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.489 ' CG2' HD21 ' A' ' 86' ' ' ASN . 3.8 mm -54.99 103.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 109.839 -0.43 . . . . 1.3899999999999999 109.839 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.607 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -72.17 -40.56 67.86 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.132 0.491 . . . . 2.5499999999999998 109.786 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.714 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -58.99 178.54 0.11 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.487 -0.779 . . . . 2.5600000000000001 109.401 179.297 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.556 ' H ' ' NE2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -136.39 -40.79 0.64 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.464 -0.494 . . . . 2.71 112.147 -178.23 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.646 ' HG2' HE22 ' A' ' 83' ' ' GLN . 18.9 ptp180 -88.88 33.09 0.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.349 0.595 . . . . 2.7799999999999998 109.445 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.714 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -133.9 -33.68 1.04 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.237 -0.892 . . . . 2.4900000000000002 111.035 -179.299 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 20.6 tptp -37.88 -55.22 1.22 Allowed 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.814 -0.63 . . . . 2.2799999999999998 111.66 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.572 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 97.3 m-85 -56.05 -48.15 76.55 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.056 -0.52 . . . . 2.4900000000000002 110.901 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.43 -66.29 0.42 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.83 0.347 . . . . 0.34999999999999998 111.615 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.63 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.9 t80 -65.23 -49.1 70.97 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.995 0.739 . . . . 0.28000000000000003 112.995 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.616 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 12.2 ttt180 -54.77 -64.1 0.94 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.061 0.393 . . . . 3.3399999999999999 112.061 -176.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -51.6 -37.43 49.89 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.524 -0.547 . . . . 2.5800000000000001 109.524 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -56.92 -41.01 77.41 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.732 -0.667 . . . . 0.28999999999999998 109.531 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.63 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -61.85 -39.12 82.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 108.951 -0.759 . . . . 0.23999999999999999 108.951 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.683 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -60.4 -32.06 70.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.607 -1.179 . . . . 0.33000000000000002 109.695 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.683 ' HD2' HD22 ' A' ' 95' ' ' ASN . 10.6 mptt -62.57 -49.21 76.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.688 -0.486 . . . . 1.6399999999999999 109.688 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.675 ' CD2' HD12 ' A' ' 70' ' ' LEU . 27.7 tp -59.06 -34.24 71.72 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.634 -0.426 . . . . 0.62 110.135 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 8.0 tp10 -55.42 -57.66 10.96 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.031 -0.531 . . . . 1.8700000000000001 110.185 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 45.6 m-80 -63.92 -40.02 95.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 2.1200000000000001 111.123 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.579 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -51.05 -48.65 61.49 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.26000000000000001 109.999 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.579 ' HG ' HD22 ' A' ' 100' ' ' ASN . 5.6 mt -67.25 -38.5 85.27 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.261 -0.644 . . . . 0.57999999999999996 109.261 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.655 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 64.7 mtp180 -54.92 -37.59 66.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.275 -0.875 . . . . 2.0899999999999999 111.473 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -90.59 -15.49 30.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.244 -0.434 . . . . 2.3199999999999998 111.616 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.565 HD11 ' CE2' ' A' ' 121' ' ' PHE . 6.3 tp -87.3 -22.15 25.32 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.167 1.173 . . . . 0.31 114.167 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.829 ' H ' HE21 ' A' ' 105' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.378 0 C-N-CA 120.776 -0.37 . . . . 2.04 111.795 -178.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.565 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.1 m-30 . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.536 0.208 . . . . 0.46999999999999997 111.233 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m -77.82 -14.28 59.62 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.855 -0.338 . . . . 1.26 110.449 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.454 ' HB2' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.8 -42.57 63.75 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.007 -0.738 . . . . 2.5800000000000001 109.007 179.007 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.485 ' O ' HD12 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.25 -23.73 67.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.538 -0.912 . . . . 0.26000000000000001 108.538 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.9 -48.47 30.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.858 -1.064 . . . . 1.3 110.089 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.7 t -63.05 -34.53 77.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.022 -0.535 . . . . 1.3999999999999999 110.881 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 70.4 m -63.21 -48.64 77.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.968 -0.56 . . . . 1.0900000000000001 111.502 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.476 HG13 ' HB ' ' A' ' 43' ' ' THR . 64.8 t -58.53 -52.89 54.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.864 0.364 . . . . 0.51000000000000001 111.295 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -50.8 -42.26 57.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 2.6899999999999999 111.271 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.6 tt0 -58.1 -56.11 26.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 2.1000000000000001 112.265 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.575 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.89 -55.7 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 120.946 0.403 . . . . 0.28999999999999998 111.111 -178.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 40.0 t -54.03 -47.68 71.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.04 -0.527 . . . . 1.02 110.407 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.51 -20.28 19.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.37 111.858 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.426 HG21 ' N ' ' A' ' 90' ' ' PHE . 89.9 mt -89.15 -30.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.731 0.641 . . . . 0.26000000000000001 112.731 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.623 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -83.05 -50.94 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 114.665 1.358 . . . . 0.25 114.665 -177.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 . . . . . 0 C--N 1.326 -0.44 0 N-CA-C 113.338 0.866 . . . . 0.91000000000000003 113.338 -176.841 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.459 HG23 ' HB3' ' A' ' 73' ' ' PHE . 48.8 mm . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 121.186 0.517 . . . . 0.39000000000000001 111.91 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 p -127.64 -178.25 4.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.576 -0.738 . . . . 0.35999999999999999 109.296 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.621 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -62.52 -37.71 87.1 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.2 -0.6 . . . . 0.98999999999999999 110.014 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.52 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -57.75 -46.75 91.91 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.635 -0.793 . . . . 0.14999999999999999 111.147 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.6 t -65.42 -38.48 82.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.508 0.671 . . . . 1.28 109.525 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.39 95.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 114.806 -1.088 . . . . 0.17000000000000001 110.374 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.458 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 19.1 mt -60.92 -48.33 82.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.203 -0.453 . . . . 0.20999999999999999 110.466 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.3 -28.85 63.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.079 0.466 . . . . 0.23999999999999999 110.273 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.809 ' HB2' HD23 ' A' ' 70' ' ' LEU . 58.0 m -78.87 -35.48 43.68 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.705 -0.679 . . . . 0.34000000000000002 110.926 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.499 HG23 HD21 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -73.69 -26.97 60.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.208 0.528 . . . . 0.41999999999999998 109.909 178.464 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -80.93 -50.03 10.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.532 -0.758 . . . . 1.52 109.922 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.3 -46.71 36.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.005 -0.543 . . . . 0.28000000000000003 110.838 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.636 HD22 ' HA2' ' A' ' 67' ' ' GLY . 4.2 pp -69.87 -41.81 74.32 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.879 -0.415 . . . . 0.29999999999999999 109.879 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.1 t -53.82 -45.59 70.86 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.222 -0.444 . . . . 0.23000000000000001 110.949 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.98 -42.86 99.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.2 110.185 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.46 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . . . -55.14 -30.29 59.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.204 -0.453 . . . . 0.28000000000000003 110.166 178.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.606 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.2 mt -74.64 -39.17 46.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.289 -0.634 . . . . 0.20999999999999999 109.289 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.2 t -77.18 -10.22 59.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.232 -0.895 . . . . 0.45000000000000001 109.951 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.46 ' HE ' ' HA ' ' A' ' 49' ' ' ALA . 69.4 mtm180 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.591 -0.731 . . . . 2.9100000000000001 110.832 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 . . . . . 0 C--O 1.23 0.069 0 N-CA-C 109.406 -0.59 . . . . 1.3 109.406 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.7 t -76.65 -11.59 59.88 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.397 -0.82 . . . . 1.5800000000000001 110.752 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -48.61 13.51 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.814 -0.439 . . . . 0.33000000000000002 109.814 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.518 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -69.87 -36.29 68.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.136 -0.69 . . . . 0.20999999999999999 109.136 178.465 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.59 HD23 ' HB3' ' A' ' 104' ' ' LEU . 2.4 tm? -61.89 -57.8 10.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.91 -1.041 . . . . 0.23999999999999999 110.72 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.34 -42.67 99.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.895 -0.593 . . . . 2.3199999999999998 111.837 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.54 -32.06 72.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.28999999999999998 110.968 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.636 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -78.49 -29.68 51.91 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.178 -1.011 . . . . 0.40000000000000002 112.117 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.66 -46.31 83.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 107.997 -1.112 . . . . 0.82999999999999996 107.997 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -59.85 -42.12 92.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.475 -1.239 . . . . 0.53000000000000003 110.015 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.809 HD23 ' HB2' ' A' ' 42' ' ' SER . 2.4 tm? -62.57 -49.12 76.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.335 -0.848 . . . . 1.4099999999999999 110.686 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.545 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . 1.4 t80 -59.02 -36.13 74.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.724 -0.671 . . . . 0.75 109.938 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 9.0 p -74.19 -24.81 59.41 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.877 -0.601 . . . . 1.1299999999999999 112.559 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.459 ' HB3' HG23 ' A' ' 34' ' ' ILE . 17.8 m-85 -78.78 -44.4 23.32 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 119.544 -0.862 . . . . 0.28000000000000003 109.377 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.562 ' SG ' HG23 ' A' ' 94' ' ' ILE . 13.0 p -66.99 -21.72 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.37 -0.832 . . . . 0.90000000000000002 109.534 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.412 HG12 ' N ' ' A' ' 76' ' ' SER . 0.6 OUTLIER -72.45 -43.93 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.42999999999999999 110.09 179.001 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.412 ' N ' HG12 ' A' ' 75' ' ' VAL . 53.9 m -85.51 -2.5 58.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.90000000000000002 110.253 178.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.442 ' HB3' ' O ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -99.26 -30.24 12.36 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.64 -0.709 . . . . 0.25 111.806 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.479 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.4 m -63.63 -2.86 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.121 0.415 . . . . 0.97999999999999998 112.121 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -77.6 8.04 4.86 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.27 -0.423 . . . . 1.3100000000000001 110.474 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.3 p -119.55 -10.45 9.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.032 -0.531 . . . . 1.49 110.884 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.533 HG21 ' HB2' ' A' ' 87' ' ' LYS . 35.6 mm -50.31 131.37 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 116.354 -0.385 . . . . 1.3899999999999999 110.897 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.674 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.3 OUTLIER -111.8 -31.19 7.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 116.407 -0.36 . . . . 2.5499999999999998 111.692 -178.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.559 ' HB3' HD22 ' A' ' 86' ' ' ASN . 0.3 OUTLIER -43.99 -43.03 6.38 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.175 0.805 . . . . 2.5600000000000001 113.175 -179.144 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.674 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 23.7 mmt 80.73 -92.89 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.701 0.63 . . . . 2.71 112.701 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -57.82 -9.88 1.46 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.003 0.43 . . . . 2.7799999999999998 111.077 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.559 HD22 ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -107.95 -19.3 13.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.763 -0.653 . . . . 2.4900000000000002 110.18 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.643 ' HD2' ' HA ' ' A' ' 84' ' ' MET . 0.0 OUTLIER -52.32 -38.74 59.36 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.324 0.583 . . . . 2.2799999999999998 109.463 179.036 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.583 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 84.2 m-85 -57.41 -42.83 83.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.796 -1.093 . . . . 2.4900000000000002 109.992 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.01 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.34999999999999998 111.224 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.616 ' CE2' HD11 ' A' ' 94' ' ' ILE . 78.3 t80 -70.32 -45.59 65.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.31 -0.404 . . . . 0.28000000000000003 111.917 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.671 ' HA ' HD12 ' A' ' 94' ' ' ILE . 9.4 ttp180 -56.73 -63.42 1.21 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.385 -0.37 . . . . 3.3399999999999999 111.482 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -54.15 -34.8 61.28 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.325 -0.62 . . . . 2.5800000000000001 109.325 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -57.45 -40.15 77.83 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.884 -0.784 . . . . 0.28999999999999998 108.884 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.671 HD12 ' HA ' ' A' ' 91' ' ' ARG . 61.0 mt -60.48 -38.79 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 CA-C-N 115.139 -0.937 . . . . 0.23999999999999999 109.085 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.684 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -63.4 -34.31 77.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.487 -1.233 . . . . 0.33000000000000002 109.725 179.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.684 ' HD2' HD22 ' A' ' 95' ' ' ASN . 12.1 mptt -59.21 -45.26 91.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.657 -0.497 . . . . 1.6399999999999999 109.657 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.711 ' CD2' HD12 ' A' ' 70' ' ' LEU . 28.7 tp -64.52 -31.77 73.12 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 116.339 -0.392 . . . . 0.62 110.305 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.1 -51.2 70.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.217 -0.447 . . . . 1.8700000000000001 110.191 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 40.2 m-80 -72.65 -37.87 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.023 -0.535 . . . . 2.1200000000000001 111.016 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.573 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -50.27 -45.54 54.44 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.499 -0.556 . . . . 0.26000000000000001 109.499 178.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.573 ' HG ' HD22 ' A' ' 100' ' ' ASN . 7.5 mt -66.82 -38.86 87.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.364 -0.835 . . . . 0.57999999999999996 109.14 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.574 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 48.6 mtt-85 -57.6 -35.12 70.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.427 -0.806 . . . . 2.0899999999999999 111.214 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -88.02 -18.47 28.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.169 0.509 . . . . 2.3199999999999998 109.845 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.59 ' HB3' HD23 ' A' ' 64' ' ' LEU . 14.9 tp -81.1 -34.67 32.46 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 114.092 1.145 . . . . 0.31 114.092 -178.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.597 ' H ' HE21 ' A' ' 105' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.495 0 C-N-CA 120.103 -0.639 . . . . 2.04 110.457 -177.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.474 ' CD2' HD11 ' A' ' 104' ' ' LEU . 2.7 m-30 . . . . . 0 N--CA 1.453 -0.323 0 N-CA-C 111.644 0.239 . . . . 0.46999999999999997 111.644 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 93.6 p -83.08 -25.57 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.709 -0.478 . . . . 1.26 109.709 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -67.17 -31.07 71.23 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.32 -0.993 . . . . 2.5800000000000001 108.32 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.484 ' O ' HD12 ' A' ' 124' ' ' LEU . 2.2 tp -70.11 -22.95 62.97 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.155 -0.929 . . . . 0.26000000000000001 108.55 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.82 -49.67 19.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.066 -0.97 . . . . 1.3 110.069 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 m -67.12 -30.1 70.02 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.93 -0.577 . . . . 1.3999999999999999 110.486 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.5 m -65.56 -44.76 85.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.831 -0.622 . . . . 1.0900000000000001 111.11 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 43' ' ' THR . 41.7 t -61.64 -53.8 43.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.51000000000000001 111.32 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -51.87 -39.14 58.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.208 -0.451 . . . . 2.6899999999999999 111.118 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' HG13 ' A' ' 134' ' ' ILE . 0.9 OUTLIER -61.03 -50.8 71.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 2.1000000000000001 112.311 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.562 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.0 OUTLIER -55.18 -55.48 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.78 0.324 . . . . 0.28999999999999998 111.053 -178.826 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.1 t -53.48 -45.56 69.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 1.02 111.131 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.71 -34.0 50.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.004 0.372 . . . . 0.37 112.004 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 130' ' ' GLU . 52.6 mt -74.42 -51.23 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.661 0.615 . . . . 0.26000000000000001 112.661 -179.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.621 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -56.79 -35.51 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 112.517 0.562 . . . . 0.25 112.517 -178.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 . . . . . 0 C--N 1.318 -0.766 0 C-N-CA 120.701 -0.4 . . . . 0.91000000000000003 110.307 -179.973 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.5 mm . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 121.091 0.472 . . . . 0.39000000000000001 110.726 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.5 p -129.22 -175.27 3.51 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.734 . . . . 0.35999999999999999 109.347 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.636 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -63.41 -30.99 72.02 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.203 -0.666 . . . . 0.98999999999999999 109.203 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.441 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.52 -47.81 79.98 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.134 -0.787 . . . . 0.14999999999999999 111.134 178.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 52.2 t -63.91 -40.3 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 CA-C-O 121.682 0.753 . . . . 1.28 109.25 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -39.84 86.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.339 -1.3 . . . . 0.17000000000000001 110.8 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.419 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 20.5 mt -65.81 -49.24 68.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.434 -0.348 . . . . 0.20999999999999999 110.422 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -54.38 -33.51 59.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.59 -0.522 . . . . 0.23999999999999999 109.59 178.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m -70.97 -41.72 70.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.561 -0.745 . . . . 0.34000000000000002 110.789 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.684 HG23 HD11 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -63.75 -33.2 75.13 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.948 0.404 . . . . 0.41999999999999998 110.703 179.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -72.74 -55.05 7.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 1.52 111.367 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.11 -47.51 23.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.28000000000000003 111.296 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.759 HD21 HD22 ' A' ' 70' ' ' LEU . 4.1 pp -71.08 -38.88 72.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.29999999999999999 110.08 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.438 ' N ' HD12 ' A' ' 46' ' ' LEU . 34.6 t -53.89 -52.27 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 0.23000000000000001 110.416 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mp -60.2 -35.03 74.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.033 -0.53 . . . . 1.2 110.003 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -60.23 -35.58 75.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.28000000000000003 109.75 178.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.0 mt -69.56 -40.2 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 N-CA-C 109.027 -0.731 . . . . 0.20999999999999999 109.027 178.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.9 t -75.02 -9.38 58.48 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.022 -0.99 . . . . 0.45000000000000001 109.98 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 115.543 -0.753 . . . . 2.9100000000000001 110.793 -179.985 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 t-80 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.761 0.315 . . . . 1.3 110.866 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.2 p -97.12 -33.79 11.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.978 0.418 . . . . 1.5800000000000001 110.713 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.49 -55.06 4.93 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.491 0.923 . . . . 0.33000000000000002 113.491 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.548 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -64.85 -32.23 57.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 120.716 -0.394 . . . . 0.20999999999999999 110.834 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -70.76 -58.4 3.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.453 -0.339 . . . . 0.23999999999999999 111.192 178.623 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -58.59 -44.67 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.385 0.612 . . . . 2.3199999999999998 110.343 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.89 -26.51 63.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.343 -0.984 . . . . 0.28999999999999998 108.343 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.89 -46.64 91.08 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 114.835 -1.075 . . . . 0.40000000000000002 112.488 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -64.99 -42.91 94.1 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.881 0.372 . . . . 0.82999999999999996 110.826 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -58.09 -39.04 77.59 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.924 -0.58 . . . . 0.53000000000000003 110.777 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.759 HD22 HD21 ' A' ' 46' ' ' LEU . 10.6 tp -66.63 -50.58 62.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 1.4099999999999999 111.337 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.46 ' CD1' ' HB2' ' A' ' 98' ' ' GLU . 15.1 t80 -54.76 -35.75 64.11 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.083 -0.71 . . . . 0.75 109.083 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 t -67.14 -41.96 85.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.999 -1.0 . . . . 1.1299999999999999 111.848 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.4 -43.31 81.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 119.918 -0.713 . . . . 0.28000000000000003 110.47 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.483 ' HG ' ' HZ ' ' A' ' 90' ' ' PHE . 1.1 m -62.79 -22.89 66.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.90000000000000002 109.972 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.432 HG12 ' N ' ' A' ' 76' ' ' SER . 1.2 t -75.17 -45.72 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.576 -0.738 . . . . 0.42999999999999999 111.03 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.432 ' N ' HG12 ' A' ' 75' ' ' VAL . 49.1 m -83.87 -3.32 57.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 0.90000000000000002 110.665 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -96.38 -32.21 12.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.811 -0.631 . . . . 0.25 111.326 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.4 m -67.86 -6.06 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.048 0.451 . . . . 0.97999999999999998 111.674 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -79.6 8.46 6.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.119 -0.491 . . . . 1.3100000000000001 110.084 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 t -127.64 -5.16 5.84 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.853 -0.612 . . . . 1.49 111.054 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.68 HG13 ' HG3' ' A' ' 87' ' ' LYS . 28.9 mm -31.75 -66.02 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.079 0 N-CA-C 112.417 0.525 . . . . 1.3899999999999999 112.417 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.563 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 77.49 -43.88 0.42 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.263 0.838 . . . . 2.5499999999999998 113.263 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.741 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 1.5 mt-30 -50.33 -26.39 4.8 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.039 0.755 . . . . 2.5600000000000001 113.039 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.5 ' C ' ' H ' ' A' ' 86' ' ' ASN . 27.6 mtm 74.47 -86.87 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.973 1.101 . . . . 2.71 113.973 177.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.403 ' H ' ' HB2' ' A' ' 84' ' ' MET . 15.4 ptm180 -64.75 6.36 0.23 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.963 0.411 . . . . 2.7799999999999998 111.722 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.741 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -119.39 -12.51 9.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.528 0.68 . . . . 2.4900000000000002 109.407 -179.794 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.68 ' HG3' HG13 ' A' ' 81' ' ' ILE . 2.2 ttpp -57.8 -47.45 82.54 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.752 -1.113 . . . . 2.2799999999999998 110.751 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -55.82 -46.17 78.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.484 -0.78 . . . . 2.4900000000000002 110.75 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 92' ' ' GLU . . . -47.55 -70.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.412 0.523 . . . . 0.34999999999999998 112.412 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.588 ' CE1' HG22 ' A' ' 131' ' ' ILE . 63.7 t80 -62.47 -43.62 98.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.364 0.505 . . . . 0.28000000000000003 112.364 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.591 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 8.2 ttp180 -56.02 -62.14 1.91 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.617 -0.265 . . . . 3.3399999999999999 111.423 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -52.96 -33.1 49.51 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.522 -0.308 . . . . 2.5800000000000001 110.549 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -59.63 -39.94 85.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.478 0.656 . . . . 0.28999999999999998 109.703 178.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 90' ' ' PHE . 6.3 mt -64.25 -34.31 68.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.351 -0.84 . . . . 0.23999999999999999 109.471 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.666 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -63.41 -36.09 82.59 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.882 -1.054 . . . . 0.33000000000000002 109.308 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.666 ' HD2' HD22 ' A' ' 95' ' ' ASN . 0.8 OUTLIER -59.65 -47.63 84.87 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.213 -0.662 . . . . 1.6399999999999999 109.213 178.555 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.711 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.74 -39.75 85.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.512 -0.767 . . . . 0.62 109.832 178.452 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.46 ' HB2' ' CD1' ' A' ' 71' ' ' TYR . 8.6 tp10 -57.38 -58.01 10.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.466 -0.788 . . . . 1.8700000000000001 111.029 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.53 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 52.9 m-80 -61.79 -31.68 71.91 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.717 -0.475 . . . . 2.1200000000000001 109.717 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.779 ' ND2' HD23 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -63.14 -38.47 91.32 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.699 -0.852 . . . . 0.26000000000000001 108.699 178.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.779 HD23 ' ND2' ' A' ' 100' ' ' ASN . 8.9 mt -67.39 -41.7 84.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.159 -1.052 . . . . 0.57999999999999996 108.159 177.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.619 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 71.3 mtp180 -56.27 -38.59 71.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.242 -1.344 . . . . 2.0899999999999999 111.549 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -89.45 -17.77 28.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.035 -0.529 . . . . 2.3199999999999998 111.743 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.43 HD11 ' CD2' ' A' ' 121' ' ' PHE . 16.5 tp -86.13 -25.31 25.83 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.935 1.087 . . . . 0.31 113.935 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.783 ' H ' HE21 ' A' ' 105' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 120.554 -0.458 . . . . 2.04 110.451 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.467 ' HB2' HG21 ' A' ' 50' ' ' ILE . 1.4 m-30 . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.48 0.181 . . . . 0.46999999999999997 111.448 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.4 m -67.06 -21.54 65.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 1.26 110.363 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.426 ' HB2' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -65.67 -42.14 91.67 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.348 -0.612 . . . . 2.5800000000000001 109.348 178.864 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.605 HD13 ' ND2' ' A' ' 100' ' ' ASN . 2.4 tp -60.79 -26.51 67.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.858 -0.793 . . . . 0.26000000000000001 108.858 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 tp -70.25 -49.07 53.71 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.232 -0.895 . . . . 1.3 109.933 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -63.19 -36.15 82.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.886 -0.597 . . . . 1.3999999999999999 110.482 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 131' ' ' ILE . 74.0 m -59.72 -42.56 93.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.833 -0.622 . . . . 1.0900000000000001 110.729 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 41.8 t -60.32 -53.11 53.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.053 -0.521 . . . . 0.51000000000000001 111.019 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -50.67 -43.32 57.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 2.6899999999999999 111.33 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.81 -56.35 22.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 2.1000000000000001 112.209 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.588 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.34 -55.7 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 121.018 -0.273 . . . . 0.28999999999999998 111.179 -178.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 56.7 p -55.25 -46.26 76.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.94 0.4 . . . . 1.02 110.405 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -53.51 -21.82 7.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.089 -0.505 . . . . 0.37 111.89 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 70.1 mt -88.34 -48.39 14.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.643 0.609 . . . . 0.26000000000000001 112.643 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.636 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -59.91 -50.34 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 114.371 1.248 . . . . 0.25 114.371 -177.693 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 . . . . . 0 C--N 1.325 -0.489 0 N-CA-C 112.134 0.42 . . . . 0.91000000000000003 112.134 -177.456 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.656 ' HA ' HG11 ' A' ' 38' ' ' VAL . 40.5 mm . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.21 0.528 . . . . 0.39000000000000001 112.023 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.49 ' H ' HG12 ' A' ' 38' ' ' VAL . 81.9 p -126.57 -159.57 0.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.441 -0.799 . . . . 0.35999999999999999 109.614 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.599 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -74.45 -27.76 60.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.718 -0.475 . . . . 0.98999999999999999 109.718 178.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.55 -47.96 82.26 Favored Glycine 0 N--CA 1.453 -0.188 0 CA-C-N 115.642 -0.708 . . . . 0.14999999999999999 112.021 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.656 HG11 ' HA ' ' A' ' 34' ' ' ILE . 12.4 p -66.68 -37.69 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.518 0.675 . . . . 1.28 109.366 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.438 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.1 t -63.51 -41.48 92.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.622 -1.172 . . . . 0.17000000000000001 110.962 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.425 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 31.4 mt -65.23 -51.29 61.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.789 0.328 . . . . 0.20999999999999999 110.285 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.28 -31.41 32.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.152 0.501 . . . . 0.23999999999999999 109.765 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.3 m -73.14 -42.41 62.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.415 -0.811 . . . . 0.34000000000000002 111.093 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.667 HG23 HD11 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -63.01 -35.47 80.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.338 . . . . 0.41999999999999998 111.184 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -72.95 -53.8 10.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 1.52 111.508 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.58 -47.86 28.35 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.348 -0.387 . . . . 0.28000000000000003 111.69 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.685 HD21 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -70.67 -39.63 73.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.483 -0.326 . . . . 0.29999999999999999 110.172 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.442 ' N ' HD12 ' A' ' 46' ' ' LEU . 47.2 t -55.25 -37.98 67.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.23000000000000001 109.93 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.67 -36.25 78.28 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.661 -0.7 . . . . 1.2 109.717 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.74 77.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.605 -0.517 . . . . 0.28000000000000003 109.605 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.534 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -71.96 -27.37 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 N-CA-C 108.779 -0.823 . . . . 0.20999999999999999 108.779 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -83.72 -14.82 50.73 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.18 -0.918 . . . . 0.45000000000000001 109.696 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 115.588 -0.733 . . . . 2.9100000000000001 111.323 -179.865 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 121.005 0.431 . . . . 1.3 109.989 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -78.34 -9.02 59.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.662 -0.699 . . . . 1.5800000000000001 110.539 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.67 -45.81 23.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.33000000000000002 110.403 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.534 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -76.19 -27.9 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.718 -0.673 . . . . 0.20999999999999999 109.974 179.006 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.614 HD21 ' NE2' ' A' ' 105' ' ' GLN . 2.1 tm? -73.9 -52.45 12.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.35 -0.841 . . . . 0.23999999999999999 110.793 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -60.23 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.484 0.659 . . . . 2.3199999999999998 109.463 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.99 -27.9 67.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.064 -0.971 . . . . 0.28999999999999998 108.419 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.78 -47.31 87.48 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.874 -1.057 . . . . 0.40000000000000002 112.154 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -38.14 86.14 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.057 0.456 . . . . 0.82999999999999996 110.098 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 69' ' ' ASN . 0.9 OUTLIER -60.22 -46.03 91.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.658 -0.701 . . . . 0.53000000000000003 110.5 179.685 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.685 HD22 HD21 ' A' ' 46' ' ' LEU . 14.4 tp -57.99 -48.41 80.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.766 -0.652 . . . . 1.4099999999999999 110.689 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.476 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 23.8 t80 -59.22 -34.98 72.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.201 -0.454 . . . . 0.75 110.059 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 t -76.46 -19.33 58.14 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.85 -0.614 . . . . 1.1299999999999999 112.009 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -84.71 -44.64 13.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.789 -0.819 . . . . 0.28000000000000003 108.789 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 4.3 m -69.44 -20.33 63.77 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.643 -0.708 . . . . 0.90000000000000002 109.09 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.476 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.8 OUTLIER -72.96 -45.37 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-N 115.617 -0.719 . . . . 0.42999999999999999 110.364 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.423 ' N ' HG12 ' A' ' 75' ' ' VAL . 43.7 t -81.17 -11.06 59.52 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 121.064 0.459 . . . . 0.90000000000000002 110.357 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.481 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -93.57 -29.19 15.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.668 -0.696 . . . . 0.25 110.407 179.713 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.568 HG21 ' HG2' ' A' ' 91' ' ' ARG . 0.3 OUTLIER -62.1 -30.05 47.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.846 -0.615 . . . . 0.97999999999999998 111.858 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.87 -4.45 20.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.067 0.461 . . . . 1.3100000000000001 110.297 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -104.87 7.07 34.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.688 -0.687 . . . . 1.49 111.444 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.602 ' HB ' ' HD2' ' A' ' 87' ' ' LYS . 5.5 mm -70.11 95.92 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.868 0.366 . . . . 1.3899999999999999 110.952 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.612 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.0 OUTLIER -80.91 -26.04 37.08 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.76 -0.83 . . . . 2.5499999999999998 108.76 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.841 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 5.7 mm100 -37.63 -41.65 0.49 Allowed 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.201 -1.363 . . . . 2.5600000000000001 113.9 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.612 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 19.1 mmt 82.09 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.856 1.058 . . . . 2.71 113.856 178.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -71.74 29.92 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.976 0.417 . . . . 2.7799999999999998 111.3 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.841 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -138.8 -23.94 0.93 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.891 -0.595 . . . . 2.4900000000000002 110.795 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 5.4 mtmt -39.13 -54.52 1.74 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.859 -0.61 . . . . 2.2799999999999998 111.045 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.405 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 88.5 m-85 -55.34 -48.94 73.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.534 -0.757 . . . . 2.4900000000000002 111.453 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.435 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -47.03 -69.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.909 0.337 . . . . 0.34999999999999998 111.909 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.592 ' CE2' HG22 ' A' ' 131' ' ' ILE . 33.4 t80 -60.05 -44.55 94.61 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.184 0.438 . . . . 0.28000000000000003 112.184 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.626 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -55.1 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.585 0.231 . . . . 3.3399999999999999 111.387 -178.337 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 12.1 pt-20 -50.82 -36.74 38.88 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.333 -0.394 . . . . 2.5800000000000001 110.235 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -59.11 -39.63 82.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.125 0.488 . . . . 0.28999999999999998 109.822 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 90' ' ' PHE . 9.1 mt -62.97 -38.97 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.23999999999999999 109.396 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.527 ' ND2' ' N ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -57.57 -43.62 84.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.834 -1.075 . . . . 0.33000000000000002 110.045 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.527 ' N ' ' ND2' ' A' ' 95' ' ' ASN . 0.1 OUTLIER -56.42 -50.36 71.86 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.336 -0.393 . . . . 1.6399999999999999 110.264 179.159 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.785 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -54.93 -41.62 71.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.816 -0.629 . . . . 0.62 109.804 178.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 95' ' ' ASN . 7.8 tp10 -57.1 -59.97 4.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.443 -0.799 . . . . 1.8700000000000001 110.881 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -66.72 -9.33 35.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 2.1200000000000001 110.227 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.779 HD22 HD23 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -85.13 -37.73 19.89 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.516 -1.29 . . . . 0.26000000000000001 107.516 178.773 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.785 HD21 ' CD1' ' A' ' 97' ' ' LEU . 7.6 mt -67.75 -39.88 84.16 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.416 -1.327 . . . . 0.57999999999999996 107.416 177.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.612 ' O ' ' HB2' ' A' ' 105' ' ' GLN . 75.1 mtt180 -55.9 -53.52 55.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.293 -1.321 . . . . 2.0899999999999999 110.686 178.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -68.93 -23.89 64.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.709 -0.478 . . . . 2.3199999999999998 109.709 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.402 HD23 HD23 ' A' ' 64' ' ' LEU . 38.6 tp -76.13 -17.54 59.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.621 -0.718 . . . . 0.31 110.339 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.614 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 115.68 -0.691 . . . . 2.04 110.398 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.483 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.163 0 N-CA-C 112.176 0.436 . . . . 0.46999999999999997 112.176 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 88.6 p -75.68 -16.7 60.14 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.737 -0.468 . . . . 1.26 109.737 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.433 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 3.4 mppt? -69.9 -41.91 74.08 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.049 -0.722 . . . . 2.5800000000000001 109.049 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.704 HD13 ' ND2' ' A' ' 100' ' ' ASN . 1.3 tp -61.63 -25.31 67.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.575 -0.898 . . . . 0.26000000000000001 108.575 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.29 -48.7 49.1 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.007 -0.997 . . . . 1.3 109.925 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 50.7 m -63.43 -35.75 81.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.754 -0.657 . . . . 1.3999999999999999 110.51 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 131' ' ' ILE . 39.9 t -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 1.0900000000000001 110.74 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.601 HG22 HG22 ' A' ' 43' ' ' THR . 17.9 t -60.87 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 0.51000000000000001 111.124 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -54.57 -38.28 66.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.577 -0.738 . . . . 2.6899999999999999 112.073 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -60.86 -56.17 24.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.474 0.546 . . . . 2.1000000000000001 112.474 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.592 HG22 ' CE2' ' A' ' 90' ' ' PHE . 1.3 mt -52.68 -54.15 17.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 121.078 0.466 . . . . 0.28999999999999998 110.811 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.5 t -53.45 -47.91 69.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.762 -0.653 . . . . 1.02 111.18 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.16 -25.81 61.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.37 111.626 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 78.1 mt -73.33 -51.88 23.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.039 0.385 . . . . 0.26000000000000001 112.039 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.599 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -62.19 -35.94 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.309 0.485 . . . . 0.25 112.309 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 120.981 -0.288 . . . . 0.91000000000000003 111.231 -179.728 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.788 ' HA ' HG11 ' A' ' 38' ' ' VAL . 37.1 mm . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.25 0.548 . . . . 0.39000000000000001 111.091 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.609 ' O ' HG12 ' A' ' 38' ' ' VAL . 73.9 p -125.65 -158.98 0.87 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.766 -0.828 . . . . 0.35999999999999999 108.766 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.564 ' HB2' HG21 ' A' ' 135' ' ' VAL . 6.1 ttpt -66.5 -35.93 81.48 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.91 -0.716 . . . . 0.98999999999999999 109.141 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.21 -49.37 63.78 Favored Glycine 0 N--CA 1.452 -0.237 0 CA-C-N 114.989 -1.005 . . . . 0.14999999999999999 113.005 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.788 HG11 ' HA ' ' A' ' 34' ' ' ILE . 9.7 p -65.26 -37.81 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.205 0 CA-C-O 121.467 0.651 . . . . 1.28 109.866 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.486 ' O ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -65.03 -36.31 77.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 114.671 -1.15 . . . . 0.17000000000000001 111.08 -179.753 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.468 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 26.8 mt -71.13 -51.54 24.41 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.916 -0.314 . . . . 0.20999999999999999 110.548 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -54.04 -34.18 59.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.23999999999999999 109.801 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.623 ' CB ' HD23 ' A' ' 70' ' ' LEU . 65.9 m -73.62 -44.16 57.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.401 -0.818 . . . . 0.34000000000000002 111.179 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.67 HG23 HD21 ' A' ' 70' ' ' LEU . 0.8 OUTLIER -64.25 -31.44 72.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.986 0.422 . . . . 0.41999999999999998 110.566 178.622 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -72.46 -54.94 7.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.826 -0.625 . . . . 1.52 111.06 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.79 -47.33 20.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.115 -0.493 . . . . 0.28000000000000003 111.382 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.466 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.1 pp -72.11 -38.83 69.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.827 -0.349 . . . . 0.29999999999999999 110.355 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.453 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.4 t -55.35 -37.65 67.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.23000000000000001 110.249 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.96 -38.82 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.923 -0.58 . . . . 1.2 110.0 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.38 -46.3 76.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.717 -0.475 . . . . 0.28000000000000003 109.717 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.615 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -62.3 -39.74 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.817 -0.809 . . . . 0.20999999999999999 108.817 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.0 t -61.43 -17.04 52.47 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.585 -0.895 . . . . 0.45000000000000001 108.585 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.3 mtt180 . . . . . 0 N--CA 1.452 -0.334 0 CA-C-N 114.854 -1.066 . . . . 2.9100000000000001 110.923 179.581 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 . . . . . 0 CA--C 1.522 -0.118 0 N-CA-C 109.466 -0.568 . . . . 1.3 109.466 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.8 m -70.88 -8.25 51.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.473 -0.785 . . . . 1.5800000000000001 110.335 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -47.17 15.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.155 0.502 . . . . 0.33000000000000002 109.996 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.615 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.98 -28.79 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.449 -0.796 . . . . 0.20999999999999999 109.775 178.832 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.632 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.0 OUTLIER -73.86 -51.49 16.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.132 -0.94 . . . . 0.23999999999999999 111.015 179.002 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.48 -50.72 70.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.242 0.544 . . . . 2.3199999999999998 109.723 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.74 -26.91 67.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.375 -0.972 . . . . 0.28999999999999998 108.375 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.452 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -64.14 -46.48 90.97 Favored Glycine 0 N--CA 1.442 -0.906 0 CA-C-N 114.865 -1.061 . . . . 0.40000000000000002 112.324 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.18 -41.83 99.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.74 0.305 . . . . 0.82999999999999996 110.687 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.477 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.7 m-80 -58.42 -40.46 82.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.53000000000000003 110.995 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.67 HD21 HG23 ' A' ' 43' ' ' THR . 2.6 tm? -65.35 -50.47 65.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 1.4099999999999999 110.865 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.447 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 12.6 t80 -56.44 -29.86 62.15 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.375 -0.972 . . . . 0.75 108.375 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 32.8 t -67.73 -53.35 28.16 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.927 -1.033 . . . . 1.1299999999999999 111.112 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.03 -43.62 95.18 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.306 -0.558 . . . . 0.28000000000000003 111.715 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -52.09 67.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.927 0.394 . . . . 0.90000000000000002 110.904 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.45 -33.92 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.42999999999999999 112.871 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.5 t -90.92 -13.36 33.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.038 0.447 . . . . 0.90000000000000002 110.794 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.487 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -88.24 -24.2 23.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.684 -0.689 . . . . 0.25 111.379 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.7 m -69.8 -12.89 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.97999999999999998 111.374 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -68.59 -5.64 21.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 1.3100000000000001 110.355 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.8 m -118.36 6.89 11.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.854 -0.612 . . . . 1.49 111.449 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.51 ' CG2' HD21 ' A' ' 86' ' ' ASN . 1.0 OUTLIER -47.68 -24.95 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.211 0.448 . . . . 1.3899999999999999 112.211 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.557 HE21 ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 64.32 -70.38 0.08 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.144 0.497 . . . . 2.5499999999999998 110.276 -177.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.646 HE21 ' H ' ' A' ' 84' ' ' MET . 2.3 mm100 -51.8 173.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.122 -0.945 . . . . 2.5600000000000001 109.801 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.646 ' H ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -140.42 -20.22 0.85 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.46 -0.496 . . . . 2.71 111.418 -178.196 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -95.34 15.86 18.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.857 -0.794 . . . . 2.7799999999999998 108.857 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.765 HD22 ' H ' ' A' ' 86' ' ' ASN . 0.1 OUTLIER -128.87 -30.88 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.863 -1.062 . . . . 2.4900000000000002 110.863 -179.029 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.65 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 11.1 tttm -42.37 -52.23 4.64 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.878 -0.601 . . . . 2.2799999999999998 111.916 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -55.04 -45.89 75.28 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.846 -0.341 . . . . 2.4900000000000002 110.827 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -50.58 -71.0 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.914 0.387 . . . . 0.34999999999999998 111.987 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.583 ' CE1' HG22 ' A' ' 131' ' ' ILE . 71.4 t80 -61.37 -46.02 91.92 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.476 0.547 . . . . 0.28000000000000003 112.476 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.65 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -56.48 -57.96 10.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.536 0.207 . . . . 3.3399999999999999 111.235 -178.084 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.7 pt-20 -50.3 -37.64 37.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.4 -0.364 . . . . 2.5800000000000001 110.165 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.0 -41.66 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.38 0.61 . . . . 0.28999999999999998 109.569 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.576 HD11 ' CE2' ' A' ' 90' ' ' PHE . 17.8 mt -62.48 -42.97 97.78 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.433 -0.803 . . . . 0.23999999999999999 109.328 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.643 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -55.7 -38.9 70.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.86 -1.064 . . . . 0.33000000000000002 109.371 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.643 ' HD2' HD22 ' A' ' 95' ' ' ASN . 1.1 mptm? -57.17 -46.98 82.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.978 -0.556 . . . . 1.6399999999999999 109.956 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.588 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 33.2 tp -58.96 -36.15 74.34 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 120.956 0.408 . . . . 0.62 110.147 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.7 OUTLIER -57.24 -59.08 5.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.871 -0.604 . . . . 1.8700000000000001 110.169 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 34.1 m-80 -71.31 -10.06 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.853 -0.612 . . . . 2.1200000000000001 111.032 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.503 ' ND2' HD13 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -79.47 -47.95 14.75 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 108.58 -0.896 . . . . 0.26000000000000001 108.58 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 7.5 mt -64.44 -33.86 76.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.393 -0.966 . . . . 0.57999999999999996 108.393 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 81.4 mtt180 -55.04 -55.68 28.3 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 114.944 -1.025 . . . . 2.0899999999999999 110.899 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -73.1 -19.69 61.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.022 0.439 . . . . 2.3199999999999998 110.47 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.556 HD23 HD23 ' A' ' 64' ' ' LEU . 51.6 tp -76.27 -16.94 59.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.769 -0.65 . . . . 0.31 111.286 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.632 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 116.374 -0.376 . . . . 2.04 111.232 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.467 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.027 0.381 . . . . 0.46999999999999997 112.027 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 80.2 p -69.75 -17.05 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.676 -0.41 . . . . 1.26 110.014 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -48.21 68.13 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.651 -0.87 . . . . 2.5800000000000001 108.651 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.522 ' O ' HD12 ' A' ' 124' ' ' LEU . 1.5 tp -54.24 -25.76 24.98 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.214 -0.903 . . . . 0.26000000000000001 109.251 177.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.78 -48.41 54.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.328 -0.851 . . . . 1.3 110.247 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.5 p -66.85 -35.04 79.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.126 -0.488 . . . . 1.3999999999999999 111.116 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 26.0 t -62.77 -42.53 99.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 1.0900000000000001 111.302 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 124' ' ' LEU . 42.6 t -63.14 -50.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.113 -0.494 . . . . 0.51000000000000001 110.852 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -53.19 -37.65 62.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.89 -0.595 . . . . 2.6899999999999999 110.548 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.415 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.5 tt0 -60.46 -56.43 21.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.712 -0.677 . . . . 2.1000000000000001 112.32 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.583 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -52.62 -55.74 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.95 0.405 . . . . 0.28999999999999998 111.187 -178.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.414 ' OG ' ' NE2' ' A' ' 136' ' ' GLN . 7.5 t -54.13 -45.57 71.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.61 . . . . 1.02 111.353 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.45 -26.06 64.9 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.151 0.426 . . . . 0.37 112.151 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 130' ' ' GLU . 81.3 mt -75.5 -52.51 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 112.041 0.386 . . . . 0.26000000000000001 112.041 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.564 HG21 ' HB2' ' A' ' 36' ' ' LYS . 1.4 p -59.67 -37.45 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 112.537 0.569 . . . . 0.25 112.537 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . 0.414 ' NE2' ' OG ' ' A' ' 132' ' ' SER . 66.9 mt-30 . . . . . 0 C--N 1.322 -0.598 0 C-N-CA 120.75 -0.38 . . . . 0.91000000000000003 110.711 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.659 ' HA ' HG11 ' A' ' 38' ' ' VAL . 44.2 mm . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.265 0.555 . . . . 0.39000000000000001 112.215 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.518 ' O ' HG12 ' A' ' 38' ' ' VAL . 81.9 p -123.08 -160.46 0.9 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.266 -0.879 . . . . 0.35999999999999999 109.09 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.666 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.28 -30.52 60.46 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.177 -0.609 . . . . 0.98999999999999999 109.408 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.83 -47.61 89.61 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.418 -0.81 . . . . 0.14999999999999999 111.827 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.659 HG11 ' HA ' ' A' ' 34' ' ' ILE . 13.9 p -67.09 -37.97 80.32 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-O 121.455 0.645 . . . . 1.28 109.34 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.442 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.7 t -60.52 -42.79 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 114.747 -1.115 . . . . 0.17000000000000001 111.17 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.455 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.0 mt -67.11 -51.51 53.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.243 -0.28 . . . . 0.20999999999999999 110.243 178.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -52.78 -30.94 35.84 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.178 -0.675 . . . . 0.23999999999999999 109.178 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.503 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 66.2 m -73.16 -52.67 13.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.177 -0.92 . . . . 0.34000000000000002 110.664 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.66 HG23 HD21 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -55.62 -29.37 59.05 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.88 0.371 . . . . 0.41999999999999998 110.87 178.429 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -75.07 -51.86 12.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.102 -0.499 . . . . 1.52 110.661 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.23 -46.78 35.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.97 -0.559 . . . . 0.28000000000000003 110.992 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 50' ' ' ILE . 3.9 pp -72.71 -40.66 65.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.325 -0.398 . . . . 0.29999999999999999 110.173 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.458 ' N ' HD12 ' A' ' 46' ' ' LEU . 44.0 t -54.15 -36.21 63.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.089 0.471 . . . . 0.23000000000000001 110.001 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.78 -34.49 64.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 1.2 109.793 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.02 -36.13 76.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.487 -0.56 . . . . 0.28000000000000003 109.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.545 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -72.81 -32.3 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 N-CA-C 108.496 -0.927 . . . . 0.20999999999999999 108.496 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -76.97 -15.29 59.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.118 -0.946 . . . . 0.45000000000000001 109.389 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 115.512 -0.767 . . . . 2.9100000000000001 110.934 -179.964 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.094 0.473 . . . . 1.3 109.744 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 48.2 t -78.8 -10.94 59.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.66 -0.7 . . . . 1.5800000000000001 110.325 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.25 -46.18 23.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.582 . . . . 0.33000000000000002 110.341 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.545 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -71.29 -25.71 25.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.20999999999999999 109.235 178.534 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.692 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.7 tm? -75.63 -48.5 21.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.879 -1.055 . . . . 0.23999999999999999 110.425 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -61.35 -52.23 65.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.609 0.718 . . . . 2.3199999999999998 109.272 179.017 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.04 -26.84 67.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.588 -1.187 . . . . 0.28999999999999998 108.448 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.86 -49.21 69.59 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.06 -0.973 . . . . 0.40000000000000002 112.478 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.517 ' NZ ' HE22 ' A' ' 105' ' ' GLN . 1.0 OUTLIER -60.72 -43.72 97.52 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.864 0.364 . . . . 0.82999999999999996 110.399 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 73' ' ' PHE . 17.6 m-80 -58.39 -42.19 86.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.878 -0.601 . . . . 0.53000000000000003 110.777 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.66 HD21 HG23 ' A' ' 43' ' ' THR . 1.1 tm? -58.5 -48.66 80.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 1.4099999999999999 110.223 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.474 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 47.8 t80 -60.62 -33.29 72.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.75 110.914 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.4 p -80.76 -16.77 52.96 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.207 0.447 . . . . 1.1299999999999999 112.207 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 69' ' ' ASN . 24.3 m-85 -80.28 -44.29 19.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.506 -0.924 . . . . 0.28000000000000003 108.506 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 78' ' ' VAL . 7.8 m -70.93 -27.4 63.74 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.337 -0.847 . . . . 0.90000000000000002 109.15 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -64.57 -38.32 82.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-N 115.618 -0.719 . . . . 0.42999999999999999 110.95 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.8 t -91.27 -11.71 37.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.922 0.392 . . . . 0.90000000000000002 110.44 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.472 ' HB2' HG22 ' A' ' 34' ' ' ILE . 1.2 t80 -90.7 -26.58 19.48 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.919 -0.582 . . . . 0.25 111.929 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.498 HG11 ' HG2' ' A' ' 91' ' ' ARG . 2.8 m -63.06 -10.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 121.125 0.488 . . . . 0.97999999999999998 111.044 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.0 6.67 3.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.958 -0.565 . . . . 1.3100000000000001 110.598 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 41.1 t -126.66 -1.17 6.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.039 -0.528 . . . . 1.49 111.106 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.527 HG21 ' HG3' ' A' ' 87' ' ' LYS . 18.3 mm -40.74 -30.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 112.444 0.535 . . . . 1.3899999999999999 112.444 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.537 ' NE2' ' C ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 61.57 -72.36 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 123.767 0.667 . . . . 2.5499999999999998 109.863 -178.175 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.696 HE22 ' HG2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -49.02 156.5 0.51 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.256 -1.016 . . . . 2.5600000000000001 108.256 179.371 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.4 ptm -122.48 -34.66 3.22 Favored 'General case' 0 C--N 1.314 -0.957 0 C-N-CA 120.019 -0.672 . . . . 2.71 112.723 -177.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.696 ' HG2' HE22 ' A' ' 83' ' ' GLN . 39.6 ptt180 -86.02 27.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.315 -0.624 . . . . 2.7799999999999998 109.315 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.695 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -132.11 -29.47 1.63 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.9 -1.046 . . . . 2.4900000000000002 110.77 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 7.8 mttt -39.69 -50.19 2.3 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.731 -0.668 . . . . 2.2799999999999998 111.519 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -56.39 -48.74 76.27 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.238 -0.437 . . . . 2.4900000000000002 110.455 -179.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.09 -68.37 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.046 0.388 . . . . 0.34999999999999998 112.046 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.731 ' CE2' HD11 ' A' ' 94' ' ' ILE . 89.5 t80 -66.43 -50.23 64.09 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.429 0.899 . . . . 0.28000000000000003 113.429 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.625 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -58.55 -47.86 82.81 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.339 -0.144 . . . . 3.3399999999999999 111.308 -176.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 6.5 pt-20 -58.9 -37.88 77.61 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.651 -0.5 . . . . 2.5800000000000001 109.651 178.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.18 -41.28 88.11 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.172 -0.677 . . . . 0.28999999999999998 109.172 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.731 HD11 ' CE2' ' A' ' 90' ' ' PHE . 40.4 mt -60.19 -42.75 91.39 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.289 -0.869 . . . . 0.23999999999999999 109.039 178.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.624 ' ND2' ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.53 -44.79 89.69 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 114.556 -1.202 . . . . 0.33000000000000002 109.666 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.624 ' HD2' ' ND2' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -48.44 -45.82 36.92 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.093 0.473 . . . . 1.6399999999999999 109.783 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.802 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -60.63 -40.75 93.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.76 . . . . 0.62 110.055 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -55.29 -61.29 2.43 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.707 -0.679 . . . . 1.8700000000000001 111.627 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.442 ' ND2' ' O ' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -60.42 -35.44 75.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.907 -0.405 . . . . 2.1200000000000001 109.907 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.71 ' ND2' HD23 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -58.93 -34.58 71.9 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.895 -0.779 . . . . 0.26000000000000001 108.895 177.434 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.802 HD21 ' CD1' ' A' ' 97' ' ' LEU . 10.9 mt -71.06 -41.65 70.45 Favored 'General case' 0 C--N 1.34 0.171 0 N-CA-C 108.307 -0.997 . . . . 0.57999999999999996 108.307 177.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 90.8 mtt180 -54.21 -47.85 71.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.693 -1.14 . . . . 2.0899999999999999 111.478 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -79.01 -23.99 43.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.862 0.363 . . . . 2.3199999999999998 110.66 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.3 tp -73.66 -15.8 61.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.31 111.334 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.692 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.175 0 CA-C-N 116.386 -0.37 . . . . 2.04 110.912 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.427 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 1.6 m-30 . . . . . 0 C--O 1.231 0.126 0 N-CA-C 112.021 0.378 . . . . 0.46999999999999997 112.021 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 89.7 p -67.93 -15.93 63.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 1.26 110.085 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -69.97 -36.65 75.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.13 -0.693 . . . . 2.5800000000000001 109.13 178.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.573 HD13 ' ND2' ' A' ' 100' ' ' ASN . 0.3 OUTLIER -65.6 -23.81 66.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.441 -0.948 . . . . 0.26000000000000001 108.441 178.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.37 -48.62 32.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.877 -1.056 . . . . 1.3 110.309 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.2 t -66.59 -34.78 78.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.84 -0.618 . . . . 1.3999999999999999 110.86 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 131' ' ' ILE . 67.5 m -62.44 -45.7 91.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.941 -0.572 . . . . 1.0900000000000001 111.157 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 124' ' ' LEU . 46.1 t -60.52 -54.86 29.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.51000000000000001 111.51 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -50.51 -38.94 47.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.96 -0.563 . . . . 2.6899999999999999 111.39 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.09 -56.02 23.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.971 -0.558 . . . . 2.1000000000000001 112.46 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.703 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -52.36 -55.31 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.681 0.277 . . . . 0.28999999999999998 111.13 -178.743 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.467 ' HB2' HE21 ' A' ' 136' ' ' GLN . 54.4 p -53.73 -47.42 70.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 1.02 111.004 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -53.01 -29.58 30.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.38 -0.373 . . . . 0.37 111.752 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.9 mt -79.3 -51.42 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.837 0.68 . . . . 0.26000000000000001 112.837 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.666 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -57.57 -45.55 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.518 0.562 . . . . 0.25 112.518 -178.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . 0.467 HE21 ' HB2' ' A' ' 132' ' ' SER . 45.4 mt-30 . . . . . 0 C--N 1.321 -0.673 0 CA-C-N 116.465 -0.334 . . . . 0.91000000000000003 111.737 -178.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.855 0.359 . . . . 4.4699999999999998 110.864 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.45 -112.96 4.58 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.933 -0.651 . . . . 2.5 112.105 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -135.71 12.27 3.43 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.916 0.389 . . . . 2.0099999999999998 111.043 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.475 HG22 ' HB2' ' A' ' 77' ' ' TYR . 49.6 mm 64.76 98.65 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.624 -0.717 . . . . 0.39000000000000001 111.918 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.4 p -131.75 -172.44 2.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.35999999999999999 109.898 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.634 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -66.08 -33.55 76.04 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.541 -0.464 . . . . 0.98999999999999999 110.073 179.404 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.402 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.78 -45.9 94.77 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 0.14999999999999999 111.316 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.4 t -67.91 -39.97 82.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.657 0.741 . . . . 1.28 109.525 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.12 -43.28 95.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.619 -1.173 . . . . 0.17000000000000001 110.852 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.483 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 23.8 mt -60.98 -48.8 80.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.763 0.316 . . . . 0.20999999999999999 110.543 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.69 -33.25 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.23999999999999999 110.366 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.808 ' CB ' HD23 ' A' ' 70' ' ' LEU . 46.0 m -76.87 -35.41 57.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.92 -0.582 . . . . 0.34000000000000002 111.47 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.483 ' OG1' ' HA ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -71.8 -33.39 68.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.971 0.415 . . . . 0.41999999999999998 110.838 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -77.22 -48.88 16.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.02 -0.536 . . . . 1.52 110.776 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.93 -46.99 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.139 -0.482 . . . . 0.28000000000000003 110.974 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.525 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.91 -38.44 79.58 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.306 -0.406 . . . . 0.29999999999999999 110.247 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.525 ' N ' HD12 ' A' ' 46' ' ' LEU . 7.8 t -55.52 -35.68 65.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.004 0.431 . . . . 0.23000000000000001 109.847 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.18 -34.21 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.826 -0.624 . . . . 1.2 109.834 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.32 -35.4 73.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.232 -0.655 . . . . 0.28000000000000003 109.232 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.524 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.5 mt -72.11 -33.71 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.701 -0.852 . . . . 0.20999999999999999 108.701 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -74.37 -12.82 60.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.041 -0.982 . . . . 0.45000000000000001 109.6 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.444 ' C ' ' H ' ' A' ' 54' ' ' SER . 13.5 ttm180 -86.22 -20.02 29.12 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.364 -0.834 . . . . 2.9100000000000001 110.98 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.463 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 5.9 t-20 -71.44 12.13 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 1.8799999999999999 111.089 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.444 ' H ' ' C ' ' A' ' 52' ' ' ARG . 47.3 t -127.42 -24.97 3.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 2.2000000000000002 110.274 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -69.18 -27.96 65.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.843 -0.617 . . . . 3.6800000000000002 111.136 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.649 HE22 ' HB2' ' A' ' 58' ' ' ALA . 0.1 OUTLIER -178.08 41.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.122 -0.49 . . . . 4.3099999999999996 110.804 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.1 mtt 74.74 -37.56 0.36 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.641 -0.709 . . . . 3.8500000000000001 112.104 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.649 ' HB2' HE22 ' A' ' 56' ' ' GLN . . . 50.45 -117.08 1.01 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.84 -0.164 . . . . 1.9199999999999999 111.225 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 95.2 p -174.47 135.43 0.42 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.739 0.304 . . . . 2.2799999999999998 110.95 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -67.09 -23.04 65.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.204 -0.453 . . . . 1.3 109.887 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.5 m -76.9 -3.22 37.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.754 -0.657 . . . . 1.5800000000000001 110.848 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.73 -53.73 5.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.094 0.473 . . . . 0.33000000000000002 109.891 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.524 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -69.64 -28.97 39.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.20999999999999999 109.701 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.634 HD21 ' NE2' ' A' ' 105' ' ' GLN . 0.6 OUTLIER -72.23 -53.42 12.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.841 -1.072 . . . . 0.23999999999999999 110.98 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.37 -49.37 78.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.302 0.572 . . . . 2.3199999999999998 109.894 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.24 -27.32 67.12 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.368 -0.975 . . . . 0.28999999999999998 108.368 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.437 ' HA3' HD22 ' A' ' 101' ' ' LEU . . . -61.75 -47.54 89.71 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.746 -1.116 . . . . 0.40000000000000002 112.582 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.438 ' HD2' HD13 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -65.81 -41.36 91.97 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.574 0.226 . . . . 0.82999999999999996 111.224 -179.535 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.419 ' O ' ' HB2' ' A' ' 72' ' ' SER . 19.7 m-80 -58.42 -43.16 88.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.91 0.386 . . . . 0.53000000000000003 110.953 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.808 HD23 ' CB ' ' A' ' 42' ' ' SER . 3.2 tm? -64.7 -50.21 67.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.977 -0.556 . . . . 1.4099999999999999 111.133 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.41 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 7.2 t80 -56.52 -33.27 65.88 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.679 -0.86 . . . . 0.75 108.679 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 70.6 m -65.17 -50.6 65.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.012 -0.994 . . . . 1.1299999999999999 111.001 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.455 ' HB3' HG23 ' A' ' 34' ' ' ILE . 11.5 m-85 -62.17 -43.64 98.39 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.363 -0.535 . . . . 0.28000000000000003 111.639 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -51.19 70.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.263 -0.426 . . . . 0.90000000000000002 110.896 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.36 -37.79 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 112.527 0.566 . . . . 0.42999999999999999 112.527 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -86.4 -10.27 54.64 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.056 0.455 . . . . 0.90000000000000002 110.866 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.475 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -91.91 -23.55 19.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.787 -0.642 . . . . 0.25 111.778 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.0 OUTLIER -72.81 -11.44 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.949 0.404 . . . . 0.97999999999999998 111.574 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -71.9 -3.61 23.47 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 1.3100000000000001 109.681 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -110.64 1.97 18.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.45 -0.795 . . . . 1.49 111.459 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.621 HG21 ' HB2' ' A' ' 87' ' ' LYS . 23.3 mm -66.31 115.78 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 120.528 -0.469 . . . . 1.3899999999999999 110.172 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.551 ' O ' ' HG3' ' A' ' 84' ' ' MET . 0.2 OUTLIER -84.67 -29.11 25.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 121.087 0.47 . . . . 2.5499999999999998 110.099 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.687 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 15.0 mm100 -46.52 -47.08 19.55 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.26 -0.882 . . . . 2.5600000000000001 113.101 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.551 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 43.3 mtm 81.91 -91.05 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.763 0.653 . . . . 2.71 112.763 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -64.75 0.92 0.98 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.886 0.374 . . . . 2.7799999999999998 111.736 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.687 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -114.61 -17.97 11.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.067 -0.716 . . . . 2.4900000000000002 109.067 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.621 ' HB2' HG21 ' A' ' 81' ' ' ILE . 0.6 OUTLIER -58.77 -35.65 73.11 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.173 -0.921 . . . . 2.2799999999999998 109.289 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.463 ' HA ' ' HE2' ' A' ' 87' ' ' LYS . 71.1 m-85 -56.98 -44.25 82.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.574 -0.739 . . . . 2.4900000000000002 110.026 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -53.77 -61.82 2.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 0.34999999999999998 112.085 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.654 ' CE2' HD11 ' A' ' 94' ' ' ILE . 66.9 t80 -63.23 -45.59 90.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.28000000000000003 111.559 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.595 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.2 OUTLIER -58.15 -52.44 65.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 3.3399999999999999 111.723 -178.139 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 11.0 pt-20 -54.94 -36.46 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.192 -0.299 . . . . 2.5800000000000001 110.192 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.06 -40.03 88.09 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.665 0.745 . . . . 0.28999999999999998 109.123 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.654 HD11 ' CE2' ' A' ' 90' ' ' PHE . 32.9 mt -61.81 -41.2 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.174 -0.921 . . . . 0.23999999999999999 109.018 178.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.685 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.51 -39.11 79.18 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.589 -1.187 . . . . 0.33000000000000002 109.292 179.422 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.685 ' HD2' HD22 ' A' ' 95' ' ' ASN . 1.3 mptm? -54.4 -47.5 72.67 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.752 -0.462 . . . . 1.6399999999999999 109.752 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.724 ' CD2' HD12 ' A' ' 70' ' ' LEU . 33.7 tp -59.95 -32.27 70.64 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.631 -0.427 . . . . 0.62 110.197 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -58.64 -60.14 4.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.144 -0.48 . . . . 1.8700000000000001 110.736 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.441 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 0.9 OUTLIER -73.57 -10.22 59.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 2.1200000000000001 111.474 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.499 ' ND2' HD12 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.9 -47.86 19.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.723 -0.843 . . . . 0.26000000000000001 108.723 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 8.2 mt -66.42 -31.92 72.97 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.234 -0.894 . . . . 0.57999999999999996 108.659 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.441 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 87.1 mtt180 -54.69 -55.76 26.41 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.092 -0.958 . . . . 2.0899999999999999 110.764 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -71.89 -18.99 62.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.979 0.418 . . . . 2.3199999999999998 110.495 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.497 HD11 ' CE2' ' A' ' 121' ' ' PHE . 32.9 tp -79.53 -18.18 52.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.941 -0.572 . . . . 0.31 111.225 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.634 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -52.18 -95.44 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.483 -0.326 . . . . 2.04 111.322 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.465 ' H ' ' HB3' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -145.76 -48.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.45 -0.341 . . . . 1.6899999999999999 111.359 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.463 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.0 OUTLIER 66.78 154.44 0.13 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.233 -0.44 . . . . 2.4399999999999999 111.158 179.659 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -47.68 -67.75 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.641 2.227 . . . . 3.0099999999999998 112.779 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -166.79 1.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.587 -0.279 . . . . 4.4199999999999999 111.383 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.3 m -53.64 -46.54 70.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 5.4100000000000001 111.156 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.25 -72.12 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 5.8300000000000001 111.02 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.88 107.93 0.9 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.849 -0.691 . . . . 5.1600000000000001 112.322 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 79.2 p -79.1 -10.01 59.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 4.5499999999999998 111.075 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 152.86 -78.55 0.2 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.771 -0.728 . . . . 4.4199999999999999 112.877 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.46 -62.73 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.56 2.174 . . . . 5.5700000000000003 112.582 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.63 121.02 15.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.454 . . . . 3.79 111.31 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -104.46 -56.94 2.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.224 -0.444 . . . . 2.6800000000000002 110.831 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.6 p 54.47 107.83 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.423 0.63 . . . . 2.4199999999999999 111.444 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.422 HE21 ' HB3' ' A' ' 119' ' ' GLN . 9.4 mm100 -121.83 83.65 2.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.279 -0.873 . . . . 2.3500000000000001 111.159 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.5 81.59 1.81 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.496 -0.775 . . . . 2.1600000000000001 109.72 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.497 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.5 m-30 -85.02 43.1 0.98 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.46999999999999997 111.733 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.655 ' HB2' ' HZ1' ' A' ' 123' ' ' LYS . 31.0 m -71.64 -14.28 62.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.938 -0.305 . . . . 1.26 110.605 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.655 ' HZ1' ' HB2' ' A' ' 122' ' ' SER . 0.1 OUTLIER -69.64 -44.21 71.06 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.198 -0.668 . . . . 2.5800000000000001 109.198 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.526 ' O ' HD12 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -59.61 -25.44 64.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.376 -0.829 . . . . 0.26000000000000001 108.771 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tp -73.88 -48.19 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.134 -0.939 . . . . 1.3 110.636 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.5 t -63.91 -35.82 81.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.131 -0.486 . . . . 1.3999999999999999 111.123 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 131' ' ' ILE . 65.6 m -65.58 -46.74 78.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.541 . . . . 1.0900000000000001 111.91 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.45 HG13 ' HB ' ' A' ' 43' ' ' THR . 55.3 t -62.89 -55.43 23.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 0.51000000000000001 111.537 -178.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -50.61 -40.68 53.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.764 -0.653 . . . . 2.6899999999999999 111.017 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.5 -55.31 36.64 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.837 -0.62 . . . . 2.1000000000000001 112.061 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.583 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.24 -56.14 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 120.735 0.303 . . . . 0.28999999999999998 111.157 -178.857 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 30.7 t -56.61 -47.6 79.27 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.262 -0.426 . . . . 1.02 110.758 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.659 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 17.3 t70 -50.18 -26.73 4.91 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.922 -0.581 . . . . 0.37 112.28 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.1 mt -86.29 -51.21 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 113.131 0.789 . . . . 0.26000000000000001 113.131 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.634 HG21 ' HG3' ' A' ' 36' ' ' LYS . 1.4 p -53.98 -47.56 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 113.897 1.073 . . . . 0.25 113.897 -177.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . 0.583 ' HB2' ' CZ ' ' A' ' 137' ' ' ARG . 37.3 mt-30 -60.15 -37.82 81.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.636 -0.426 . . . . 0.91000000000000003 111.709 -178.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.705 ' HE ' ' N ' ' A' ' 137' ' ' ARG . 0.0 OUTLIER -94.51 28.91 2.42 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.628 -0.878 . . . . 4.0599999999999996 108.628 178.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.507 ' HG ' ' HG3' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -132.16 -35.63 1.19 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.278 -1.328 . . . . 1.8899999999999999 111.082 -178.108 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 139' ' ' GLU . 8.4 pt-20 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.543 -0.742 . . . . 4.1699999999999999 111.013 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.95 0.405 . . . . 4.4699999999999998 110.616 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.81 -114.08 4.57 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.007 -0.616 . . . . 2.5 111.903 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.18 18.78 2.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 2.0099999999999998 110.862 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.69 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.4 mm 64.83 106.69 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.514 -0.766 . . . . 0.39000000000000001 111.814 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.532 ' O ' HG12 ' A' ' 38' ' ' VAL . 81.2 p -123.45 -160.27 0.9 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.427 -0.806 . . . . 0.35999999999999999 109.179 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.652 ' HB2' HG21 ' A' ' 135' ' ' VAL . 6.5 ttpt -69.78 -39.97 76.3 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.206 -0.597 . . . . 0.98999999999999999 109.426 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -52.18 -49.6 49.5 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.251 -0.886 . . . . 0.14999999999999999 112.861 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.69 HG11 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -65.82 -38.67 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.606 0.717 . . . . 1.28 109.565 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.428 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.3 t -62.64 -38.11 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.578 -1.192 . . . . 0.17000000000000001 111.181 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.0 mt -68.18 -51.41 46.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.062 -0.347 . . . . 0.20999999999999999 110.062 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.48 -31.02 21.97 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.315 -0.624 . . . . 0.23999999999999999 109.315 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.2 m -73.96 -44.33 55.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.301 -0.863 . . . . 0.34000000000000002 110.7 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.849 HG22 HG22 ' A' ' 128' ' ' VAL . 3.6 p -60.2 -37.7 81.04 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 120.865 0.364 . . . . 0.41999999999999998 111.049 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.46 -52.91 27.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 1.52 111.29 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.12 -47.11 34.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.28000000000000003 111.572 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.794 HD21 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -74.91 -40.26 60.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.45 -0.341 . . . . 0.29999999999999999 110.742 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.437 ' N ' HD12 ' A' ' 46' ' ' LEU . 44.1 t -55.46 -39.96 71.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.048 0.451 . . . . 0.23000000000000001 110.276 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -70.3 -35.01 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 1.2 109.948 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.04 81.38 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.702 -0.481 . . . . 0.28000000000000003 109.702 178.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.632 HG12 ' HB ' ' A' ' 63' ' ' VAL . 2.0 mt -70.72 -30.18 41.04 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 N-CA-C 108.785 -0.82 . . . . 0.20999999999999999 108.785 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -79.15 -13.8 59.5 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.117 -0.947 . . . . 0.45000000000000001 109.649 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.564 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . 47.4 mtp180 -92.62 -15.93 26.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.375 -0.829 . . . . 2.9100000000000001 111.439 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.469 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 6.6 t-20 -79.44 14.54 1.55 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.8799999999999999 111.087 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 43.5 t -102.17 -14.25 17.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.251 -0.431 . . . . 2.2000000000000002 110.973 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 57' ' ' MET . 18.6 mm-40 -102.02 6.8 41.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.381 . . . . 3.6800000000000002 111.125 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 58.62 29.15 18.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.028 -0.533 . . . . 4.3099999999999996 111.329 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.41 ' HG3' ' O ' ' A' ' 55' ' ' GLU . 62.8 mtt -124.93 -0.56 7.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.386 -0.37 . . . . 3.8500000000000001 110.789 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.564 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . . . -102.23 -140.58 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 1.9199999999999999 111.103 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.6 t -175.73 140.29 0.44 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.376 -0.375 . . . . 2.2799999999999998 110.726 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -65.51 -18.84 65.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.26 -0.427 . . . . 1.3 109.861 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -78.08 -10.88 59.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.729 -0.669 . . . . 1.5800000000000001 110.27 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.28 -45.94 24.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.33000000000000002 110.206 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.632 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.13 -29.55 21.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.20999999999999999 109.896 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.677 HD23 HD23 ' A' ' 104' ' ' LEU . 1.2 tm? -74.35 -51.24 15.67 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.992 -1.004 . . . . 0.23999999999999999 111.18 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.31 -49.47 71.62 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.154 0.502 . . . . 2.3199999999999998 109.799 179.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.96 -27.41 67.44 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.258 -1.015 . . . . 0.28999999999999998 108.258 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -65.08 -46.42 88.63 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 114.795 -1.093 . . . . 0.40000000000000002 112.253 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.28 -43.94 98.04 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.847 0.356 . . . . 0.82999999999999996 110.559 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -58.44 -41.95 86.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.53000000000000003 111.033 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.794 HD22 HD21 ' A' ' 46' ' ' LEU . 12.9 tp -61.52 -47.69 84.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.2 -0.455 . . . . 1.4099999999999999 110.432 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.592 ' HB2' HD23 ' A' ' 97' ' ' LEU . 10.5 t80 -57.94 -35.42 71.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.933 -0.576 . . . . 0.75 110.228 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 53.1 p -80.23 -18.62 48.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 1.1299999999999999 112.399 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -80.31 -44.44 19.55 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.326 -0.99 . . . . 0.28000000000000003 108.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 77' ' ' TYR . 3.8 m -68.99 -27.08 65.37 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.502 -0.772 . . . . 0.90000000000000002 109.118 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.475 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.5 OUTLIER -66.14 -37.78 80.51 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.615 -0.721 . . . . 0.42999999999999999 110.801 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.5 t -91.06 -9.66 44.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.996 0.426 . . . . 0.90000000000000002 110.07 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.503 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -90.77 -28.35 18.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.634 -0.712 . . . . 0.25 111.454 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.44 ' HA ' HG12 ' A' ' 81' ' ' ILE . 3.4 m -66.1 -11.39 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.96 0.409 . . . . 0.97999999999999998 111.663 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -71.05 -2.9 17.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.975 -0.557 . . . . 1.3100000000000001 110.811 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 57.4 p -119.19 3.56 11.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.977 -0.556 . . . . 1.49 111.924 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.683 HG22 HD21 ' A' ' 86' ' ' ASN . 11.9 mm -55.22 -33.06 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 111.956 0.354 . . . . 1.3899999999999999 111.956 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.492 ' NE2' ' C ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 61.96 -66.65 0.07 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.565 0.95 . . . . 2.5499999999999998 113.565 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.515 ' O ' ' N ' ' A' ' 85' ' ' ARG . 9.5 mt-30 -46.03 -9.33 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.97 1.1 . . . . 2.5600000000000001 113.97 -177.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.546 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 7.5 ptt? 48.43 -69.92 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.566 1.321 . . . . 2.71 114.566 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 83' ' ' GLN . 34.0 ttm180 -48.97 -40.87 32.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.568 0.622 . . . . 2.7799999999999998 110.729 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.683 HD21 HG22 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -73.3 -28.2 61.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.692 -0.686 . . . . 2.4900000000000002 110.631 179.237 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.602 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -56.72 -37.05 70.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.027 -0.533 . . . . 2.2799999999999998 111.021 -179.336 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -57.03 -48.5 78.35 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.578 -0.449 . . . . 2.4900000000000002 110.067 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.91 -65.6 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.955 -0.566 . . . . 0.34999999999999998 111.875 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.594 ' CE1' HG22 ' A' ' 131' ' ' ILE . 68.0 t80 -62.83 -47.4 83.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.535 0.569 . . . . 0.28000000000000003 112.535 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.602 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.8 OUTLIER -57.99 -56.52 20.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.686 -0.233 . . . . 3.3399999999999999 111.32 -177.446 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.7 pt-20 -52.38 -36.18 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.886 -0.413 . . . . 2.5800000000000001 109.886 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -61.45 -38.91 88.92 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.366 -0.605 . . . . 0.28999999999999998 109.366 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.573 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -62.26 -40.93 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 N-CA-C 108.724 -0.843 . . . . 0.23999999999999999 108.724 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.658 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.65 -42.53 88.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.444 -1.253 . . . . 0.33000000000000002 109.225 179.238 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.658 ' HD2' HD22 ' A' ' 95' ' ' ASN . 1.1 mptm? -52.92 -40.94 63.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.501 -0.555 . . . . 1.6399999999999999 109.501 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.593 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 15.5 tp -65.3 -35.79 82.07 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.888 -0.596 . . . . 0.62 110.238 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -53.63 -61.37 2.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.076 0.465 . . . . 1.8700000000000001 110.383 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.463 ' H ' ' ND2' ' A' ' 99' ' ' ASN . 0.4 OUTLIER -63.35 -40.62 97.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.669 -0.696 . . . . 2.1200000000000001 111.156 179.054 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.537 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -49.45 -45.56 46.8 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.957 0.408 . . . . 0.26000000000000001 110.051 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 4.8 mt -68.27 -39.55 82.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.792 -0.64 . . . . 0.57999999999999996 109.537 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 47.0 mtp180 -54.59 -48.48 72.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.237 -0.892 . . . . 2.0899999999999999 111.307 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.84 -21.35 55.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.087 0.47 . . . . 2.3199999999999998 110.19 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.677 HD23 HD23 ' A' ' 64' ' ' LEU . 22.2 tp -77.79 -11.92 59.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.632 -0.713 . . . . 0.31 110.916 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.646 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -57.11 -177.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.049 -0.523 . . . . 2.04 111.146 179.837 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.455 HG23 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -63.31 -49.06 84.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 1.6899999999999999 110.459 -179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.455 ' N ' HG23 ' A' ' 106' ' ' ILE . 9.1 p 25.64 95.72 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.298 0 N-CA-C 113.261 0.837 . . . . 2.4399999999999999 113.261 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -64.95 -63.12 0.08 OUTLIER 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 123.329 2.686 . . . . 3.0099999999999998 112.076 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.448 ' HA ' ' HB2' ' A' ' 113' ' ' SER . . . -174.08 9.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.022 -0.536 . . . . 4.4199999999999999 111.032 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -51.36 -41.49 60.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.006 -0.543 . . . . 5.4100000000000001 111.269 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.62 -33.22 60.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 5.8300000000000001 111.244 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 137.92 53.51 0.05 OUTLIER Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.736 -0.745 . . . . 5.1600000000000001 112.566 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.448 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 49.1 m -109.18 173.63 6.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.901 0.381 . . . . 4.5499999999999998 111.1 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -153.44 -75.45 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.835 -0.698 . . . . 4.4199999999999999 112.646 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.36 -65.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.441 2.094 . . . . 5.5700000000000003 112.4 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 53.61 84.37 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.317 -0.401 . . . . 3.79 111.067 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -149.72 -178.56 6.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 2.6800000000000002 111.058 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 p 47.79 77.78 0.09 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.943 0.877 . . . . 2.4199999999999999 110.71 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -80.51 83.9 6.22 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.921 -1.49 . . . . 2.3500000000000001 111.103 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -119.86 83.67 2.08 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.961 -0.755 . . . . 2.1600000000000001 108.961 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.436 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.5 OUTLIER -78.46 42.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.727 -0.67 . . . . 0.46999999999999997 111.871 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 58.7 m -66.45 -15.26 63.2 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.837 -0.345 . . . . 1.26 110.221 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.437 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.41 -40.11 67.42 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.123 -0.695 . . . . 2.5800000000000001 109.123 178.752 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.514 ' O ' HD12 ' A' ' 124' ' ' LEU . 1.7 tp -65.5 -15.97 63.2 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.895 -0.78 . . . . 0.26000000000000001 108.895 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.81 -48.18 13.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.173 -0.922 . . . . 1.3 110.15 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.9 p -73.54 -29.36 62.4 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 1.3999999999999999 110.741 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.0 t -69.32 -49.13 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.883 -0.599 . . . . 1.0900000000000001 110.691 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.849 HG22 HG22 ' A' ' 43' ' ' THR . 0.3 OUTLIER -61.25 -42.15 92.39 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 115.372 -0.831 . . . . 0.51000000000000001 110.832 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -64.35 -33.9 76.9 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.878 -0.601 . . . . 2.6899999999999999 110.404 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -59.59 -46.53 88.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.761 -0.654 . . . . 2.1000000000000001 110.751 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.594 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.5 OUTLIER -57.25 -55.65 19.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.923 0.392 . . . . 0.28999999999999998 110.464 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 135' ' ' VAL . 1.4 t -53.68 -42.74 68.27 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.911 -0.586 . . . . 1.02 110.809 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.77 -37.89 77.29 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.998 -0.546 . . . . 0.37 112.066 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.507 ' O ' ' HB2' ' A' ' 138' ' ' LEU . 72.8 mt -64.46 -53.1 46.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 112.057 0.392 . . . . 0.26000000000000001 112.057 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.652 HG21 ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.05 -40.8 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 N-CA-C 112.793 0.664 . . . . 0.25 112.793 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -55.1 -54.61 40.97 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.935 0.346 . . . . 0.91000000000000003 111.935 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.496 HH21 HG23 ' A' ' 134' ' ' ILE . 0.0 OUTLIER -79.28 -14.65 58.88 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.253 0.549 . . . . 4.0599999999999996 109.706 179.313 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 134' ' ' ILE . 0.6 OUTLIER -62.71 -74.57 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.275 -0.875 . . . . 1.8899999999999999 111.357 -179.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.174 -0.917 . . . . 4.1699999999999999 111.186 -179.841 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.41 ' OG ' HD13 ' A' ' 34' ' ' ILE . 87.2 p . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 121.017 0.437 . . . . 4.4699999999999998 110.434 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -108.07 80.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.697 -0.683 . . . . 2.5 111.479 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 49.79 21.82 0.73 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.069 0.462 . . . . 2.0099999999999998 111.523 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.681 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.1 mm 62.66 107.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.379 -0.828 . . . . 0.39000000000000001 112.152 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.525 ' O ' HG12 ' A' ' 38' ' ' VAL . 72.0 p -124.02 -160.35 0.92 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.319 -0.855 . . . . 0.35999999999999999 109.342 178.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.626 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -75.5 -27.14 58.67 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.467 -0.568 . . . . 0.98999999999999999 109.467 178.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.64 -46.58 93.43 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.46 -0.791 . . . . 0.14999999999999999 111.832 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.681 HG11 ' HA ' ' A' ' 34' ' ' ILE . 11.4 p -68.88 -36.03 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.688 0.756 . . . . 1.28 109.29 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.403 HG22 ' SG ' ' A' ' 74' ' ' CYS . 1.5 t -63.26 -43.66 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.467 -1.242 . . . . 0.17000000000000001 110.764 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.498 HD12 ' HE3' ' A' ' 36' ' ' LYS . 26.4 mt -61.73 -51.12 69.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.798 0.332 . . . . 0.20999999999999999 110.254 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -54.64 -30.09 54.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.23999999999999999 110.166 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.793 ' HB2' HD23 ' A' ' 70' ' ' LEU . 70.2 m -79.38 -36.79 38.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.624 -0.716 . . . . 0.34000000000000002 111.456 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.568 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -71.33 -26.93 63.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.177 0.513 . . . . 0.41999999999999998 109.802 178.698 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -80.85 -45.74 16.39 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.592 -0.731 . . . . 1.52 109.956 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -49.91 -47.26 52.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.928 -0.578 . . . . 0.28000000000000003 111.043 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.565 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -72.66 -39.28 67.25 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.726 -0.39 . . . . 0.29999999999999999 110.056 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.565 ' N ' HD12 ' A' ' 46' ' ' LEU . 51.9 t -54.2 -42.25 69.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.128 -0.487 . . . . 0.23000000000000001 110.276 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -38.4 81.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.77 -0.65 . . . . 1.2 109.682 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . -57.25 -28.97 63.42 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.28000000000000003 109.803 178.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -75.88 -39.37 37.78 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 108.888 -0.782 . . . . 0.20999999999999999 108.888 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t -73.13 -10.04 59.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.273 -0.876 . . . . 0.45000000000000001 109.595 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 21.0 mmt180 -83.14 -20.81 34.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.159 -0.928 . . . . 2.9100000000000001 110.437 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -103.78 6.28 36.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.893 -0.594 . . . . 1.8799999999999999 110.957 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.6 p -114.3 -41.18 3.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.341 -0.39 . . . . 2.2000000000000002 111.432 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.497 ' HB2' HE22 ' A' ' 56' ' ' GLN . 21.3 mm-40 -88.09 -0.66 57.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.759 0.314 . . . . 3.6800000000000002 110.794 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.497 HE22 ' HB2' ' A' ' 55' ' ' GLU . 0.4 OUTLIER -172.49 -139.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.05 -0.523 . . . . 4.3099999999999996 110.15 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 79.6 mtp -132.61 108.46 9.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.694 0.283 . . . . 3.8500000000000001 110.986 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -119.01 -102.72 0.42 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.261 -0.427 . . . . 1.9199999999999999 111.139 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.9 t -173.75 135.12 0.5 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.845 0.355 . . . . 2.2799999999999998 111.243 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -68.0 -21.56 65.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.129 -0.487 . . . . 1.3 109.755 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -75.08 -10.4 59.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.618 -0.719 . . . . 1.5800000000000001 110.473 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.92 -48.41 14.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.044 -0.526 . . . . 0.33000000000000002 110.098 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.463 ' CG2' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -73.17 -35.79 48.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.277 -0.638 . . . . 0.20999999999999999 109.277 178.441 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.659 HD21 ' NE2' ' A' ' 105' ' ' GLN . 2.0 tm? -64.15 -54.9 26.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.037 -0.983 . . . . 0.23999999999999999 110.689 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.08 -48.88 78.23 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.258 -0.428 . . . . 2.3199999999999998 111.726 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.2 -25.1 65.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.066 -0.516 . . . . 0.28999999999999998 110.893 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.559 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -83.55 -30.15 30.78 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.176 -1.011 . . . . 0.40000000000000002 112.402 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.77 ' HD2' HD13 ' A' ' 101' ' ' LEU . 15.7 mmmt -63.99 -35.23 80.01 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.977 -1.12 . . . . 0.82999999999999996 107.977 177.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -70.0 -43.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.479 -1.237 . . . . 0.53000000000000003 109.9 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.854 HD12 HD22 ' A' ' 97' ' ' LEU . 3.4 tm? -59.08 -48.1 82.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.298 -0.864 . . . . 1.4099999999999999 110.147 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.555 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 10.7 t80 -61.14 -33.25 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.908 -0.587 . . . . 0.75 109.64 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 t -73.29 -26.85 61.24 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.673 -0.694 . . . . 1.1299999999999999 112.03 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -81.61 -43.55 18.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 119.725 -0.79 . . . . 0.28000000000000003 109.452 -178.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.403 ' SG ' HG22 ' A' ' 39' ' ' VAL . 15.4 m -64.31 -43.8 93.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.704 -0.68 . . . . 0.90000000000000002 109.672 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.93 -39.75 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.955 -0.566 . . . . 0.42999999999999999 111.995 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.4 t -86.73 -11.21 51.78 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.997 -0.681 . . . . 0.90000000000000002 110.441 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.522 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.6 OUTLIER -90.68 -23.96 20.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.755 -0.657 . . . . 0.25 112.146 -179.395 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.49 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.6 m -70.28 -8.4 10.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.182 0.515 . . . . 0.97999999999999998 111.221 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -74.77 -0.99 20.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.861 -0.609 . . . . 1.3100000000000001 110.357 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 80.2 p -114.05 4.79 15.81 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.962 -0.563 . . . . 1.49 111.325 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.607 HG21 ' HB2' ' A' ' 87' ' ' LYS . 25.0 mm -70.4 92.88 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 116.474 -0.33 . . . . 1.3899999999999999 111.197 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.555 HE21 ' HA ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -59.81 -34.76 73.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.781 -0.822 . . . . 2.5499999999999998 108.781 178.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.626 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 1.6 mp0 -60.82 172.14 1.02 Allowed 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 114.905 -1.043 . . . . 2.5600000000000001 109.969 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 4.9 ptm -144.06 -43.77 0.26 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.326 -0.397 . . . . 2.71 111.335 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -81.99 9.69 7.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.665 0.745 . . . . 2.7799999999999998 109.045 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.626 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -126.89 -32.51 2.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.587 -1.188 . . . . 2.4900000000000002 110.041 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.607 ' HB2' HG21 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -50.65 -44.63 57.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.387 -0.824 . . . . 2.2799999999999998 111.067 179.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.522 ' N ' ' HD2' ' A' ' 87' ' ' LYS . 2.2 p90 -56.89 -46.8 81.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.4 0.619 . . . . 2.4900000000000002 110.219 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -52.77 -59.7 4.17 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.949 -1.023 . . . . 0.34999999999999998 112.193 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.622 ' CE1' HG22 ' A' ' 131' ' ' ILE . 68.8 t80 -66.13 -48.09 71.96 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.263 0.468 . . . . 0.28000000000000003 112.263 -179.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.516 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.5 OUTLIER -56.61 -52.92 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.462 -0.335 . . . . 3.3399999999999999 110.795 -177.728 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 10.5 pt-20 -55.52 -36.87 67.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 2.5800000000000001 110.382 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.2 -39.25 85.88 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.433 0.635 . . . . 0.28999999999999998 109.731 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.604 HD11 ' CE2' ' A' ' 90' ' ' PHE . 21.2 mt -62.63 -40.97 90.41 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.404 0 CA-C-N 115.357 -0.838 . . . . 0.23999999999999999 108.806 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.603 ' ND2' ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.51 -40.83 83.97 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.497 -1.229 . . . . 0.33000000000000002 109.186 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.603 ' HD2' ' ND2' ' A' ' 95' ' ' ASN . 11.0 mptt -51.95 -49.89 62.26 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.374 -0.375 . . . . 1.6399999999999999 110.133 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.854 HD22 HD12 ' A' ' 70' ' ' LEU . 30.7 tp -58.44 -32.25 68.53 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 116.079 -0.51 . . . . 0.62 110.606 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.59 -60.08 4.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.373 -0.376 . . . . 1.8700000000000001 110.495 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.438 ' ND2' ' H ' ' A' ' 99' ' ' ASN . 0.8 OUTLIER -72.59 -10.04 59.31 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.119 -0.491 . . . . 2.1200000000000001 111.587 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.492 ' ND2' HD12 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.72 -43.95 21.68 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.37 -0.974 . . . . 0.26000000000000001 108.37 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.77 HD13 ' HD2' ' A' ' 68' ' ' LYS . 10.5 mt -68.11 -33.19 74.05 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.053 -0.976 . . . . 0.57999999999999996 108.45 178.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -54.95 -55.55 29.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.854 -1.066 . . . . 2.0899999999999999 110.534 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -71.76 -21.95 61.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.001 0.429 . . . . 2.3199999999999998 110.575 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.627 HD23 HD23 ' A' ' 64' ' ' LEU . 29.3 tp -77.77 -17.99 56.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.31 111.339 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.659 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -51.87 162.27 0.45 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.322 -0.399 . . . . 2.04 111.234 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.655 HG23 ' H ' ' A' ' 107' ' ' CYS . 0.7 OUTLIER -56.13 -66.9 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.265 -0.425 . . . . 1.6899999999999999 111.517 -179.635 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.655 ' H ' HG23 ' A' ' 106' ' ' ILE . 11.2 t 67.82 144.48 0.1 OUTLIER Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.375 -0.375 . . . . 2.4399999999999999 110.511 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.563 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 51.7 Cg_exo -53.23 -66.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.513 2.142 . . . . 3.0099999999999998 112.84 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.429 ' HB1' ' HA ' ' A' ' 113' ' ' SER . . . -165.34 4.43 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.58 -0.282 . . . . 4.4199999999999999 111.464 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.1 m -54.05 -30.71 49.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.369 -0.378 . . . . 5.4100000000000001 111.245 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.42 29.14 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 5.8300000000000001 111.261 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 129.59 -100.82 0.51 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.888 -0.673 . . . . 5.1600000000000001 112.228 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.429 ' HA ' ' HB1' ' A' ' 109' ' ' ALA . 45.6 t -170.93 -99.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.868 0.366 . . . . 4.5499999999999998 111.259 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . 0.453 ' H ' ' HD2' ' A' ' 115' ' ' PRO . . . -140.9 -68.02 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.996 -0.621 . . . . 4.4199999999999999 112.678 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.453 ' HD2' ' H ' ' A' ' 114' ' ' GLY . 25.7 Cg_endo -62.21 -57.13 0.53 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.445 2.097 . . . . 5.5700000000000003 112.354 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -92.73 102.6 15.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 3.79 110.852 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -138.03 -35.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 2.6800000000000002 111.5 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.4 p 56.32 104.19 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.455 0.645 . . . . 2.4199999999999999 110.989 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -105.89 83.52 1.93 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.164 -0.926 . . . . 2.3500000000000001 111.225 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -125.0 82.58 2.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.41 -0.814 . . . . 2.1600000000000001 109.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.517 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.6 OUTLIER -80.05 42.66 0.57 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.86 -0.609 . . . . 0.46999999999999997 111.951 -177.937 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 43.9 m -66.82 -15.91 63.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.917 -0.401 . . . . 1.26 109.917 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.452 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 3.0 mppt? -70.89 -44.38 66.42 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.715 -0.846 . . . . 2.5800000000000001 108.715 178.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.496 ' O ' HD12 ' A' ' 124' ' ' LEU . 1.4 tp -60.23 -22.1 62.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.463 -0.789 . . . . 0.26000000000000001 108.945 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -48.81 29.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.258 -0.883 . . . . 1.3 109.872 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.1 m -67.12 -31.68 72.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.703 -0.681 . . . . 1.3999999999999999 110.667 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.473 ' O ' HG13 ' A' ' 131' ' ' ILE . 68.6 m -66.98 -41.73 86.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 1.0900000000000001 111.218 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.568 HG13 ' HB ' ' A' ' 43' ' ' THR . 26.2 t -63.42 -56.16 18.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.13 -0.486 . . . . 0.51000000000000001 111.074 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.0 mmtt -52.67 -36.48 57.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.56 -0.746 . . . . 2.6899999999999999 111.341 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.408 ' O ' HG13 ' A' ' 134' ' ' ILE . 40.3 tt0 -62.5 -51.61 66.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.106 -0.497 . . . . 2.1000000000000001 112.278 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.622 HG22 ' CE1' ' A' ' 90' ' ' PHE . 1.3 mt -55.23 -55.23 17.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 C-N-CA 120.942 -0.303 . . . . 0.28999999999999998 110.96 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.1 p -55.21 -45.77 75.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 1.02 111.275 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.79 -31.29 58.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.33 -0.396 . . . . 0.37 111.739 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.598 HG23 HH21 ' A' ' 137' ' ' ARG . 91.1 mt -74.78 -51.25 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 112.877 0.695 . . . . 0.26000000000000001 112.877 -178.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.626 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -56.57 -41.62 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 112.296 0.48 . . . . 0.25 112.296 -179.056 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -55.1 -31.96 61.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.309 -0.405 . . . . 0.91000000000000003 111.848 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.598 HH21 HG23 ' A' ' 134' ' ' ILE . 3.3 mtm180 -99.46 -17.2 18.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.404 0.621 . . . . 4.0599999999999996 109.505 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 135' ' ' VAL . 4.2 tt -58.75 -89.13 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.083 -0.962 . . . . 1.8899999999999999 110.664 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.454 ' H ' ' HB3' ' A' ' 138' ' ' LEU . 45.0 mt-10 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.259 -0.876 . . . . 4.1699999999999999 110.951 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.853 0.359 . . . . 4.4699999999999998 110.644 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.24 40.58 49.15 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 2.5 111.961 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 46.76 23.44 0.25 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.115 0.413 . . . . 2.0099999999999998 112.115 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.633 ' HA ' HG11 ' A' ' 38' ' ' VAL . 47.0 mm 63.7 111.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.757 -0.656 . . . . 0.39000000000000001 112.065 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.551 ' O ' HG12 ' A' ' 38' ' ' VAL . 77.5 p -129.55 -159.42 0.96 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.291 -0.868 . . . . 0.35999999999999999 109.483 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.685 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.3 -30.86 60.49 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.384 -0.527 . . . . 0.98999999999999999 109.733 178.463 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -60.85 -46.14 95.12 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.539 -0.755 . . . . 0.14999999999999999 112.046 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.633 HG11 ' HA ' ' A' ' 34' ' ' ILE . 10.8 p -66.97 -39.3 83.14 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 1.28 109.522 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.446 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -63.23 -43.38 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 114.825 -1.079 . . . . 0.17000000000000001 110.876 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.473 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.2 mt -63.11 -46.85 85.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.71 0.29 . . . . 0.20999999999999999 110.521 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.9 -32.63 67.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.966 0.412 . . . . 0.23999999999999999 110.224 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.803 ' CB ' HD23 ' A' ' 70' ' ' LEU . 39.3 m -77.47 -35.45 53.79 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.747 -0.661 . . . . 0.34000000000000002 111.371 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.478 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.3 OUTLIER -73.31 -26.6 61.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.509 . . . . 0.41999999999999998 109.816 178.545 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -79.11 -47.26 16.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.509 -0.769 . . . . 1.52 110.161 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.51 -47.29 63.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.054 -0.521 . . . . 0.28000000000000003 111.024 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.616 HD22 ' HA2' ' A' ' 67' ' ' GLY . 4.2 pp -69.97 -40.28 75.48 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.821 -0.352 . . . . 0.29999999999999999 110.182 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.549 ' N ' HD12 ' A' ' 46' ' ' LEU . 53.9 t -57.31 -41.69 80.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.043 -0.526 . . . . 0.23000000000000001 110.889 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.4 mp -65.88 -39.86 91.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 1.2 110.238 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.84 -39.65 71.71 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.78 -0.452 . . . . 0.28000000000000003 109.78 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 46' ' ' LEU . 1.9 mt -70.12 -38.5 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.228 0 N-CA-C 108.902 -0.777 . . . . 0.20999999999999999 108.902 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -71.14 -14.55 62.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.45000000000000001 109.18 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.65 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . 15.5 mtp180 -91.94 -18.55 23.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.266 -0.879 . . . . 2.9100000000000001 111.137 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -95.54 3.13 54.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.101 -0.5 . . . . 1.8799999999999999 110.707 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -115.11 -29.28 6.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.271 -0.422 . . . . 2.2000000000000002 111.255 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.426 ' HB2' ' NE2' ' A' ' 56' ' ' GLN . 13.6 mm-40 -108.58 -15.26 14.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 3.6800000000000002 110.666 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.489 ' NE2' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -141.31 -147.68 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.871 -0.604 . . . . 4.3099999999999996 110.015 179.839 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.8 mtp -136.53 70.13 1.41 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.413 -0.358 . . . . 3.8500000000000001 110.897 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.65 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . . . -80.56 -101.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 1.9199999999999999 110.86 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.3 t -172.39 136.76 0.81 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.266 0.555 . . . . 2.2799999999999998 112.086 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -68.05 -29.45 68.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.351 -0.841 . . . . 1.3 110.013 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -77.61 -5.11 49.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 1.5800000000000001 111.17 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.97 -48.98 10.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.973 0.416 . . . . 0.33000000000000002 110.515 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.531 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -68.05 -39.48 81.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.826 -0.624 . . . . 0.20999999999999999 110.258 179.334 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 104' ' ' LEU . 1.1 tm? -65.02 -56.06 15.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.442 -0.799 . . . . 0.23999999999999999 111.224 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.14 -44.04 95.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.342 -0.39 . . . . 2.3199999999999998 111.596 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.63 -45.71 85.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.041 -0.527 . . . . 0.28999999999999998 111.063 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.616 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -62.87 -31.36 80.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.335 -0.936 . . . . 0.40000000000000002 112.578 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -44.31 96.14 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.464 -0.939 . . . . 0.82999999999999996 108.464 177.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -62.68 -38.63 91.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.61 -1.177 . . . . 0.53000000000000003 110.341 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.803 HD23 ' CB ' ' A' ' 42' ' ' SER . 2.8 tm? -65.77 -49.97 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.472 -0.785 . . . . 1.4099999999999999 111.069 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -53.6 -34.88 59.99 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.735 -0.839 . . . . 0.75 108.735 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.0 m -68.46 -49.67 58.14 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.042 -0.981 . . . . 1.1299999999999999 111.444 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -57.25 -43.57 83.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.92 -0.712 . . . . 0.28000000000000003 110.581 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.457 ' O ' HG13 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -60.74 -29.33 69.31 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.766 -0.652 . . . . 0.90000000000000002 109.838 178.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -37.13 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.489 -0.778 . . . . 0.42999999999999999 111.36 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.3 t -89.59 -9.03 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.90000000000000002 110.977 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.523 ' HB2' HG22 ' A' ' 34' ' ' ILE . 1.6 t80 -94.63 -29.6 14.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.0 -0.545 . . . . 0.25 111.614 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.475 ' O ' HG12 ' A' ' 81' ' ' ILE . 3.6 m -61.65 -11.92 6.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.148 0.499 . . . . 0.97999999999999998 111.034 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -80.19 8.67 6.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.769 -0.65 . . . . 1.3100000000000001 109.877 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 58.5 m -117.53 -8.99 10.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.694 -0.685 . . . . 1.49 110.693 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.56 HG21 ' HG3' ' A' ' 87' ' ' LYS . 34.6 mm -56.91 106.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 116.106 -0.497 . . . . 1.3899999999999999 110.869 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.684 HE21 ' C ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER -67.93 -48.39 66.09 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.936 0.398 . . . . 2.5499999999999998 110.133 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.58 ' HB2' ' ND2' ' A' ' 86' ' ' ASN . 28.7 mt-30 -59.31 -174.55 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.77 -0.65 . . . . 2.5600000000000001 109.955 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -152.46 -40.34 0.11 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.349 -0.54 . . . . 2.71 111.582 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -73.78 -1.9 21.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.642 0.734 . . . . 2.7799999999999998 109.052 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.588 ' ND2' ' N ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -115.65 -25.57 7.79 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.943 -1.026 . . . . 2.4900000000000002 110.611 -179.807 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.588 ' N ' ' ND2' ' A' ' 86' ' ' ASN . 1.0 OUTLIER -45.47 -48.93 13.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.798 -0.637 . . . . 2.2799999999999998 111.083 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -56.2 -43.0 78.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.793 -0.64 . . . . 2.4900000000000002 110.75 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -55.24 -61.24 2.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.271 0.471 . . . . 0.34999999999999998 112.271 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.651 ' CE2' HD11 ' A' ' 94' ' ' ILE . 88.9 t80 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.195 0.442 . . . . 0.28000000000000003 112.195 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -54.06 -55.03 31.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 3.3399999999999999 110.654 -177.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.4 pt-20 -58.55 -34.3 70.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 2.5800000000000001 110.564 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -59.99 -37.99 81.29 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.494 0.664 . . . . 0.28999999999999998 109.823 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.651 HD11 ' CE2' ' A' ' 90' ' ' PHE . 11.0 mt -66.11 -36.22 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 115.336 -0.847 . . . . 0.23999999999999999 109.123 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.688 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -61.74 -32.09 72.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.86 -1.063 . . . . 0.33000000000000002 109.22 179.115 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.688 ' HD2' HD22 ' A' ' 95' ' ' ASN . 0.7 OUTLIER -63.89 -48.67 75.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.526 -0.546 . . . . 1.6399999999999999 109.526 178.581 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.743 ' CD2' HD12 ' A' ' 70' ' ' LEU . 23.5 tp -58.11 -33.59 69.29 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 116.165 -0.47 . . . . 0.62 109.951 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.494 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 7.5 tp10 -57.75 -59.24 5.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.892 -0.594 . . . . 1.8700000000000001 110.424 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.566 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 29.3 m-80 -72.75 -9.93 59.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 2.1200000000000001 111.181 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.65 ' ND2' HD13 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -78.41 -47.94 16.51 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 108.683 -0.858 . . . . 0.26000000000000001 108.683 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 5.9 mt -65.5 -34.44 78.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.323 -0.991 . . . . 0.57999999999999996 108.323 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.566 ' HD2' ' HA ' ' A' ' 99' ' ' ASN . 98.2 mtt180 -55.49 -50.03 70.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.942 -1.026 . . . . 2.0899999999999999 111.256 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.75 -22.13 50.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.106 0.479 . . . . 2.3199999999999998 110.136 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 64' ' ' LEU . 42.0 tp -69.37 -17.31 63.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.721 -0.672 . . . . 0.31 110.83 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.648 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -48.26 130.2 15.98 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.769 0.319 . . . . 2.04 110.517 179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.509 HG23 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -56.18 -53.09 43.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 1.6899999999999999 111.307 -179.012 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.509 ' N ' HG23 ' A' ' 106' ' ' ILE . 13.3 t 179.07 140.19 0.28 Allowed Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 120.542 0.21 . . . . 2.4399999999999999 110.847 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.423 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 39.4 Cg_exo -57.56 -37.77 95.99 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.44 2.093 . . . . 3.0099999999999998 111.467 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.586 ' HA ' ' HB2' ' A' ' 113' ' ' SER . . . 72.46 2.35 4.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.739 -1.119 . . . . 4.4199999999999999 111.077 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.0 m -80.72 -27.37 36.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.026 -0.534 . . . . 5.4100000000000001 110.838 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -86.76 -67.5 0.81 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.92 -0.582 . . . . 5.8300000000000001 111.364 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -152.49 -27.57 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.693 -0.765 . . . . 5.1600000000000001 112.854 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.586 ' HB2' ' HA ' ' A' ' 109' ' ' ALA . 47.9 t 63.9 164.11 0.13 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.979 0.418 . . . . 4.5499999999999998 111.407 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 164.81 142.18 3.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.812 -0.708 . . . . 4.4199999999999999 112.335 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 105.97 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 5.5700000000000003 112.216 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -71.57 -43.31 66.56 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 3.79 111.389 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . 61.51 -174.42 0.13 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.352 -0.385 . . . . 2.6800000000000002 111.345 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 43.3 p 47.42 75.98 0.12 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.99 0.9 . . . . 2.4199999999999999 110.971 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -87.51 84.88 7.08 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.822 -1.535 . . . . 2.3500000000000001 111.309 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -104.71 81.51 1.78 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.293 -0.632 . . . . 2.1600000000000001 109.293 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.468 ' HB2' HG21 ' A' ' 50' ' ' ILE . 2.0 m-30 -104.38 42.47 1.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.46999999999999997 112.234 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 96.4 p -73.18 -17.15 61.4 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.702 -0.481 . . . . 1.26 109.702 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 123' ' ' LYS . 29.8 mmmt -66.83 -52.61 41.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 109.135 -0.691 . . . . 2.5800000000000001 109.135 178.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.65 HD13 ' ND2' ' A' ' 100' ' ' ASN . 0.8 OUTLIER -51.41 -27.04 9.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.001 -0.999 . . . . 0.26000000000000001 109.049 177.544 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.46 -49.71 38.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.266 -0.879 . . . . 1.3 110.214 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 89.7 p -64.43 -34.26 77.78 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.903 -0.59 . . . . 1.3999999999999999 111.128 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 t -62.31 -46.88 86.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 1.0900000000000001 111.529 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.478 HG13 ' HB ' ' A' ' 43' ' ' THR . 53.8 t -60.87 -50.23 81.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.51000000000000001 111.311 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -50.71 -43.82 57.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.035 -0.53 . . . . 2.6899999999999999 110.92 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.414 ' O ' HG13 ' A' ' 134' ' ' ILE . 10.9 tp10 -59.26 -55.47 34.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.638 -0.71 . . . . 2.1000000000000001 112.79 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.585 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.0 OUTLIER -51.36 -55.07 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-O 120.826 0.346 . . . . 0.28999999999999998 111.299 -178.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 41.2 t -53.61 -48.4 69.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.11 -0.496 . . . . 1.02 111.048 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.87 -29.84 30.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.103 0.408 . . . . 0.37 112.103 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.581 HG23 HH21 ' A' ' 137' ' ' ARG . 65.7 mt -76.8 -51.31 19.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 113.012 0.745 . . . . 0.26000000000000001 113.012 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.685 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -58.03 -44.9 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.536 0.939 . . . . 0.25 113.536 -178.172 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -44.18 -40.58 5.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.825 0.676 . . . . 0.91000000000000003 112.825 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.581 HH21 HG23 ' A' ' 134' ' ' ILE . 9.9 mtm180 -84.31 -25.15 29.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.317 0.579 . . . . 4.0599999999999996 109.911 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.623 HD13 ' N ' ' A' ' 139' ' ' GLU . 0.5 OUTLIER -69.06 -63.96 0.96 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.061 -0.972 . . . . 1.8899999999999999 110.811 179.695 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.623 ' N ' HD13 ' A' ' 138' ' ' LEU . 40.6 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.138 -0.934 . . . . 4.1699999999999999 111.399 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.762 0.315 . . . . 4.4699999999999998 111.277 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 57.98 28.58 61.06 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.749 -0.739 . . . . 2.5 112.494 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 47.31 19.76 0.13 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.528 0.566 . . . . 2.0099999999999998 112.528 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.457 HG22 ' HB2' ' A' ' 77' ' ' TYR . 50.7 mm 58.88 97.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 0.39000000000000001 111.954 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.7 p -127.95 -175.95 3.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.626 -0.715 . . . . 0.35999999999999999 109.649 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.623 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -65.74 -34.29 77.83 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.372 -0.531 . . . . 0.98999999999999999 109.775 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.448 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -62.0 -43.71 98.8 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.676 -0.773 . . . . 0.14999999999999999 111.2 178.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.1 t -69.08 -40.36 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.591 0.71 . . . . 1.28 109.559 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.26 -44.16 97.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.639 -1.164 . . . . 0.17000000000000001 110.826 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.466 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 25.1 mt -60.58 -47.4 86.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.722 0.296 . . . . 0.20999999999999999 110.602 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -56.35 -31.47 63.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.23999999999999999 110.219 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.779 ' CB ' HD23 ' A' ' 70' ' ' LEU . 41.8 m -77.86 -34.85 51.53 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.761 -0.654 . . . . 0.34000000000000002 111.277 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.476 ' HB ' HG13 ' A' ' 128' ' ' VAL . 0.2 OUTLIER -73.43 -29.14 62.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.41999999999999998 109.805 178.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -79.23 -45.76 19.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.698 -0.683 . . . . 1.52 110.218 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -51.61 -47.19 63.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.043 -0.526 . . . . 0.28000000000000003 110.786 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.583 HD12 ' N ' ' A' ' 47' ' ' CYS . 4.4 pp -68.24 -39.97 82.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.526 -0.47 . . . . 0.29999999999999999 110.055 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.583 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.9 t -56.85 -41.45 77.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.211 -0.45 . . . . 0.23000000000000001 110.756 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.71 -39.15 90.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 1.2 110.191 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.68 -34.11 69.07 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.408 -0.59 . . . . 0.28000000000000003 109.408 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.585 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -72.17 -30.33 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 109.037 -0.727 . . . . 0.20999999999999999 109.037 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.6 t -81.62 -13.16 58.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.158 -0.928 . . . . 0.45000000000000001 109.689 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.489 ' C ' ' H ' ' A' ' 54' ' ' SER . 98.8 mtt180 -96.3 -17.03 20.99 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.599 -0.728 . . . . 2.9100000000000001 111.205 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.76 ' HA ' ' H ' ' A' ' 58' ' ' ALA . 14.3 t-20 -66.96 11.85 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 1.8799999999999999 111.522 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.489 ' H ' ' C ' ' A' ' 52' ' ' ARG . 54.3 m -139.02 -23.42 0.92 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.613 0.244 . . . . 2.2000000000000002 111.13 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -76.03 -35.23 59.59 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.494 -0.321 . . . . 3.6800000000000002 111.58 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.59 31.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.025 0.44 . . . . 4.3099999999999996 110.88 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 84.1 mtp 60.07 96.67 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.613 -0.721 . . . . 3.8500000000000001 111.681 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.76 ' H ' ' HA ' ' A' ' 53' ' ' ASN . . . -97.38 -20.8 17.57 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.043 -0.526 . . . . 1.9199999999999999 110.532 179.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.548 ' HB2' ' O ' ' A' ' 58' ' ' ALA . 66.3 m 80.38 141.07 0.07 Allowed 'General case' 0 C--N 1.333 -0.124 0 O-C-N 124.099 0.874 . . . . 2.2799999999999998 111.581 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' A' ' 105' ' ' GLN . 5.3 p-80 -63.51 -27.61 69.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.779 -0.646 . . . . 1.3 109.91 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.7 m -64.97 -10.21 27.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.9 -0.591 . . . . 1.5800000000000001 110.48 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.36 -51.46 7.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.917 -0.583 . . . . 0.33000000000000002 110.193 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.585 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -72.13 -34.23 49.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.58 -0.736 . . . . 0.20999999999999999 109.709 178.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' A' ' 105' ' ' GLN . 2.2 tm? -64.87 -53.29 49.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.205 -0.907 . . . . 0.23999999999999999 110.325 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.45 -45.36 91.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.863 -0.608 . . . . 2.3199999999999998 111.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.0 74.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.28999999999999998 111.288 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.556 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -75.88 -30.4 57.72 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.097 -1.049 . . . . 0.40000000000000002 112.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -64.21 -40.3 95.78 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.36 -0.978 . . . . 0.82999999999999996 108.36 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.2 m-80 -65.38 -39.23 91.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.626 -1.17 . . . . 0.53000000000000003 109.918 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.779 HD23 ' CB ' ' A' ' 42' ' ' SER . 3.0 tm? -65.55 -49.82 67.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.312 -0.858 . . . . 1.4099999999999999 110.824 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -56.52 -32.8 65.44 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.28 -1.007 . . . . 0.75 108.28 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 35.0 t -65.04 -50.28 66.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.99 -1.005 . . . . 1.1299999999999999 110.773 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.448 ' HB3' HG23 ' A' ' 34' ' ' ILE . 12.1 m-85 -63.11 -42.94 99.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.525 -0.47 . . . . 0.28000000000000003 111.456 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -50.61 73.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.346 -0.388 . . . . 0.90000000000000002 110.591 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 72' ' ' SER . 0.4 OUTLIER -55.56 -36.68 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.981 -0.554 . . . . 0.42999999999999999 112.384 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.2 t -88.28 -9.89 51.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.098 0.475 . . . . 0.90000000000000002 110.502 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.457 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -90.14 -27.97 19.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.629 -0.714 . . . . 0.25 111.295 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.2 m -69.24 -10.76 13.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.32 . . . . 0.97999999999999998 111.422 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -71.96 -2.43 18.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.126 0.489 . . . . 1.3100000000000001 110.021 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.4 t -111.61 -0.43 16.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.79 -0.641 . . . . 1.49 111.291 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.489 ' CG2' HD21 ' A' ' 86' ' ' ASN . 3.8 mm -54.99 103.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 109.839 -0.43 . . . . 1.3899999999999999 109.839 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.607 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -72.17 -40.56 67.86 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.132 0.491 . . . . 2.5499999999999998 109.786 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.714 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -58.99 178.54 0.11 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.487 -0.779 . . . . 2.5600000000000001 109.401 179.297 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.556 ' H ' ' NE2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -136.39 -40.79 0.64 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.464 -0.494 . . . . 2.71 112.147 -178.23 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.646 ' HG2' HE22 ' A' ' 83' ' ' GLN . 18.9 ptp180 -88.88 33.09 0.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.349 0.595 . . . . 2.7799999999999998 109.445 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.714 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -133.9 -33.68 1.04 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.237 -0.892 . . . . 2.4900000000000002 111.035 -179.299 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 20.6 tptp -37.88 -55.22 1.22 Allowed 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.814 -0.63 . . . . 2.2799999999999998 111.66 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.572 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 97.3 m-85 -56.05 -48.15 76.55 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.056 -0.52 . . . . 2.4900000000000002 110.901 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.43 -66.29 0.42 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.83 0.347 . . . . 0.34999999999999998 111.615 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.63 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.9 t80 -65.23 -49.1 70.97 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.995 0.739 . . . . 0.28000000000000003 112.995 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.616 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 12.2 ttt180 -54.77 -64.1 0.94 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.061 0.393 . . . . 3.3399999999999999 112.061 -176.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -51.6 -37.43 49.89 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.524 -0.547 . . . . 2.5800000000000001 109.524 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -56.92 -41.01 77.41 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.732 -0.667 . . . . 0.28999999999999998 109.531 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.63 HG13 ' O ' ' A' ' 90' ' ' PHE . 11.3 mt -61.85 -39.12 82.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 108.951 -0.759 . . . . 0.23999999999999999 108.951 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.683 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -60.4 -32.06 70.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.607 -1.179 . . . . 0.33000000000000002 109.695 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.683 ' HD2' HD22 ' A' ' 95' ' ' ASN . 10.6 mptt -62.57 -49.21 76.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.688 -0.486 . . . . 1.6399999999999999 109.688 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.675 ' CD2' HD12 ' A' ' 70' ' ' LEU . 27.7 tp -59.06 -34.24 71.72 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.634 -0.426 . . . . 0.62 110.135 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 8.0 tp10 -55.42 -57.66 10.96 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.031 -0.531 . . . . 1.8700000000000001 110.185 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 45.6 m-80 -63.92 -40.02 95.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 2.1200000000000001 111.123 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.579 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -51.05 -48.65 61.49 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.26000000000000001 109.999 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.579 ' HG ' HD22 ' A' ' 100' ' ' ASN . 5.6 mt -67.25 -38.5 85.27 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.261 -0.644 . . . . 0.57999999999999996 109.261 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.655 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 64.7 mtp180 -54.92 -37.59 66.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.275 -0.875 . . . . 2.0899999999999999 111.473 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -90.59 -15.49 30.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.244 -0.434 . . . . 2.3199999999999998 111.616 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.565 HD11 ' CE2' ' A' ' 121' ' ' PHE . 6.3 tp -87.3 -22.15 25.32 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.167 1.173 . . . . 0.31 114.167 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.829 ' H ' HE21 ' A' ' 105' ' ' GLN . 0.0 OUTLIER -61.56 -29.94 70.34 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.776 -0.37 . . . . 2.04 111.795 -178.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.595 HG22 ' OE1' ' A' ' 105' ' ' GLN . 0.3 OUTLIER -179.75 -52.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.303 0.483 . . . . 1.6899999999999999 112.303 178.649 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.488 ' N ' ' CG2' ' A' ' 106' ' ' ILE . 53.1 t 67.1 142.38 0.08 OUTLIER Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.376 -0.375 . . . . 2.4399999999999999 110.653 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.447 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 24.8 Cg_exo -63.37 -65.7 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.59 2.193 . . . . 3.0099999999999998 112.392 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.402 ' H ' ' H ' ' A' ' 110' ' ' THR . . . -165.27 -5.5 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.306 -0.406 . . . . 4.4199999999999999 111.005 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.402 ' H ' ' H ' ' A' ' 109' ' ' ALA . 36.5 m -57.58 -31.93 66.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 5.4100000000000001 111.25 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -155.0 116.35 4.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.261 -0.427 . . . . 5.8300000000000001 111.395 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 55.58 82.91 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.914 -0.66 . . . . 5.1600000000000001 112.536 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.4 m -64.79 -93.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.953 0.406 . . . . 4.5499999999999998 111.239 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -75.63 -168.76 25.27 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.868 -0.605 . . . . 4.4199999999999999 112.606 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.74 -13.4 32.17 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 122.222 1.948 . . . . 5.5700000000000003 112.213 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -108.88 98.24 7.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.003 -0.544 . . . . 3.79 110.933 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -158.19 -61.31 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 2.6800000000000002 111.146 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.9 t 177.14 108.83 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.812 -0.631 . . . . 2.4199999999999999 111.114 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -93.8 83.7 4.45 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.244 -0.889 . . . . 2.3500000000000001 110.652 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -140.6 81.19 1.79 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.215 -0.902 . . . . 2.1600000000000001 109.609 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.565 ' CE2' HD11 ' A' ' 104' ' ' LEU . 3.1 m-30 -86.61 42.5 1.01 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 0.46999999999999997 111.233 -178.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m -77.82 -14.28 59.62 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.855 -0.338 . . . . 1.26 110.449 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.454 ' HB2' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -72.8 -42.57 63.75 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.007 -0.738 . . . . 2.5800000000000001 109.007 179.007 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.485 ' O ' HD12 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.25 -23.73 67.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.538 -0.912 . . . . 0.26000000000000001 108.538 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.9 -48.47 30.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.858 -1.064 . . . . 1.3 110.089 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.7 t -63.05 -34.53 77.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.022 -0.535 . . . . 1.3999999999999999 110.881 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 70.4 m -63.21 -48.64 77.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.968 -0.56 . . . . 1.0900000000000001 111.502 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.476 HG13 ' HB ' ' A' ' 43' ' ' THR . 64.8 t -58.53 -52.89 54.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.864 0.364 . . . . 0.51000000000000001 111.295 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -50.8 -42.26 57.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 2.6899999999999999 111.271 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.6 tt0 -58.1 -56.11 26.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 2.1000000000000001 112.265 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.575 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.89 -55.7 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 120.946 0.403 . . . . 0.28999999999999998 111.111 -178.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 40.0 t -54.03 -47.68 71.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.04 -0.527 . . . . 1.02 110.407 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.512 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 15.6 t70 -56.51 -20.28 19.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.37 111.858 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.426 HG21 ' N ' ' A' ' 90' ' ' PHE . 89.9 mt -89.15 -30.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.731 0.641 . . . . 0.26000000000000001 112.731 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.623 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -83.05 -50.94 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 114.665 1.358 . . . . 0.25 114.665 -177.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . 0.707 ' HB2' HH21 ' A' ' 137' ' ' ARG . 37.2 mt-30 -46.18 -68.82 0.16 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.338 0.866 . . . . 0.91000000000000003 113.338 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.707 HH21 ' HB2' ' A' ' 136' ' ' GLN . 0.2 OUTLIER -76.32 35.15 0.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.052 0.454 . . . . 4.0599999999999996 111.135 -179.663 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.517 HD13 ' N ' ' A' ' 139' ' ' GLU . 1.0 OUTLIER -130.82 -55.84 1.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.022 -0.535 . . . . 1.8899999999999999 110.808 -179.487 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.517 ' N ' HD13 ' A' ' 138' ' ' LEU . 4.5 pt-20 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.106 -0.95 . . . . 4.1699999999999999 110.937 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.746 0.308 . . . . 4.4699999999999998 111.065 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 71.45 -109.7 2.94 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.035 -0.602 . . . . 2.5 112.467 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.64 15.35 2.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.912 0.387 . . . . 2.0099999999999998 111.148 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.459 HG23 ' HB3' ' A' ' 73' ' ' PHE . 48.8 mm 66.47 100.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.661 . . . . 0.39000000000000001 111.91 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 p -127.64 -178.25 4.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.576 -0.738 . . . . 0.35999999999999999 109.296 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.621 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -62.52 -37.71 87.1 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.2 -0.6 . . . . 0.98999999999999999 110.014 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.52 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -57.75 -46.75 91.91 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.635 -0.793 . . . . 0.14999999999999999 111.147 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.6 t -65.42 -38.48 82.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.508 0.671 . . . . 1.28 109.525 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.39 95.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 114.806 -1.088 . . . . 0.17000000000000001 110.374 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.458 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 19.1 mt -60.92 -48.33 82.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.203 -0.453 . . . . 0.20999999999999999 110.466 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -57.3 -28.85 63.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.079 0.466 . . . . 0.23999999999999999 110.273 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.809 ' HB2' HD23 ' A' ' 70' ' ' LEU . 58.0 m -78.87 -35.48 43.68 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.705 -0.679 . . . . 0.34000000000000002 110.926 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.499 HG23 HD21 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -73.69 -26.97 60.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.208 0.528 . . . . 0.41999999999999998 109.909 178.464 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -80.93 -50.03 10.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.532 -0.758 . . . . 1.52 109.922 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.3 -46.71 36.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.005 -0.543 . . . . 0.28000000000000003 110.838 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.636 HD22 ' HA2' ' A' ' 67' ' ' GLY . 4.2 pp -69.87 -41.81 74.32 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.879 -0.415 . . . . 0.29999999999999999 109.879 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.1 t -53.82 -45.59 70.86 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.222 -0.444 . . . . 0.23000000000000001 110.949 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.98 -42.86 99.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 1.2 110.185 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.46 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . . . -55.14 -30.29 59.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.204 -0.453 . . . . 0.28000000000000003 110.166 178.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.606 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.2 mt -74.64 -39.17 46.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.289 -0.634 . . . . 0.20999999999999999 109.289 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.2 t -77.18 -10.22 59.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.232 -0.895 . . . . 0.45000000000000001 109.951 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.477 ' HA ' ' NE2' ' A' ' 56' ' ' GLN . 69.4 mtm180 -94.33 -12.08 28.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.591 -0.731 . . . . 2.9100000000000001 110.832 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.596 ' HA ' ' H ' ' A' ' 58' ' ' ALA . 19.9 t-20 -89.4 9.22 27.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 1.8799999999999999 110.716 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.8 m -131.41 -32.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 2.2000000000000002 111.114 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.448 ' HB2' ' NE2' ' A' ' 56' ' ' GLN . 46.4 mt-10 -92.23 -29.28 16.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 3.6800000000000002 111.107 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.553 HE21 ' N ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER -134.11 -2.02 2.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.313 -0.403 . . . . 4.3099999999999996 111.016 179.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 83.6 mtp 56.08 67.46 1.0 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.154 -0.476 . . . . 3.8500000000000001 110.822 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.596 ' H ' ' HA ' ' A' ' 53' ' ' ASN . . . -72.83 -88.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 1.9199999999999999 111.192 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.425 ' N ' HD22 ' A' ' 53' ' ' ASN . 47.5 t -179.88 138.66 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.945 0.402 . . . . 2.2799999999999998 111.452 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -66.44 -21.58 66.2 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.406 -0.59 . . . . 1.3 109.406 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.7 t -76.65 -11.59 59.88 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.397 -0.82 . . . . 1.5800000000000001 110.752 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.59 -48.61 13.51 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.814 -0.439 . . . . 0.33000000000000002 109.814 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.518 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -69.87 -36.29 68.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.136 -0.69 . . . . 0.20999999999999999 109.136 178.465 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.59 HD23 ' HB3' ' A' ' 104' ' ' LEU . 2.4 tm? -61.89 -57.8 10.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.91 -1.041 . . . . 0.23999999999999999 110.72 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.34 -42.67 99.58 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.895 -0.593 . . . . 2.3199999999999998 111.837 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.54 -32.06 72.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.28999999999999998 110.968 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.636 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -78.49 -29.68 51.91 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.178 -1.011 . . . . 0.40000000000000002 112.117 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.66 -46.31 83.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 107.997 -1.112 . . . . 0.82999999999999996 107.997 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -59.85 -42.12 92.95 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.475 -1.239 . . . . 0.53000000000000003 110.015 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.809 HD23 ' HB2' ' A' ' 42' ' ' SER . 2.4 tm? -62.57 -49.12 76.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.335 -0.848 . . . . 1.4099999999999999 110.686 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.545 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . 1.4 t80 -59.02 -36.13 74.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.724 -0.671 . . . . 0.75 109.938 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 9.0 p -74.19 -24.81 59.41 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.877 -0.601 . . . . 1.1299999999999999 112.559 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.459 ' HB3' HG23 ' A' ' 34' ' ' ILE . 17.8 m-85 -78.78 -44.4 23.32 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 119.544 -0.862 . . . . 0.28000000000000003 109.377 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.562 ' SG ' HG23 ' A' ' 94' ' ' ILE . 13.0 p -66.99 -21.72 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.37 -0.832 . . . . 0.90000000000000002 109.534 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.412 HG12 ' N ' ' A' ' 76' ' ' SER . 0.6 OUTLIER -72.45 -43.93 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.42999999999999999 110.09 179.001 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.412 ' N ' HG12 ' A' ' 75' ' ' VAL . 53.9 m -85.51 -2.5 58.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.90000000000000002 110.253 178.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.442 ' HB3' ' O ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -99.26 -30.24 12.36 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.64 -0.709 . . . . 0.25 111.806 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.479 ' O ' HG12 ' A' ' 81' ' ' ILE . 1.4 m -63.63 -2.86 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.121 0.415 . . . . 0.97999999999999998 112.121 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -77.6 8.04 4.86 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.27 -0.423 . . . . 1.3100000000000001 110.474 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.3 p -119.55 -10.45 9.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.032 -0.531 . . . . 1.49 110.884 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.533 HG21 ' HB2' ' A' ' 87' ' ' LYS . 35.6 mm -50.31 131.37 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 116.354 -0.385 . . . . 1.3899999999999999 110.897 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.674 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.3 OUTLIER -111.8 -31.19 7.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 116.407 -0.36 . . . . 2.5499999999999998 111.692 -178.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.559 ' HB3' HD22 ' A' ' 86' ' ' ASN . 0.3 OUTLIER -43.99 -43.03 6.38 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.175 0.805 . . . . 2.5600000000000001 113.175 -179.144 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.674 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 23.7 mmt 80.73 -92.89 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.701 0.63 . . . . 2.71 112.701 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -57.82 -9.88 1.46 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.003 0.43 . . . . 2.7799999999999998 111.077 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.559 HD22 ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -107.95 -19.3 13.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.763 -0.653 . . . . 2.4900000000000002 110.18 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.643 ' HD2' ' HA ' ' A' ' 84' ' ' MET . 0.0 OUTLIER -52.32 -38.74 59.36 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.324 0.583 . . . . 2.2799999999999998 109.463 179.036 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.583 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 84.2 m-85 -57.41 -42.83 83.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.796 -1.093 . . . . 2.4900000000000002 109.992 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.01 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.34999999999999998 111.224 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.616 ' CE2' HD11 ' A' ' 94' ' ' ILE . 78.3 t80 -70.32 -45.59 65.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.31 -0.404 . . . . 0.28000000000000003 111.917 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.671 ' HA ' HD12 ' A' ' 94' ' ' ILE . 9.4 ttp180 -56.73 -63.42 1.21 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.385 -0.37 . . . . 3.3399999999999999 111.482 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 88' ' ' PHE . 4.7 mm-40 -54.15 -34.8 61.28 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.325 -0.62 . . . . 2.5800000000000001 109.325 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -57.45 -40.15 77.83 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.884 -0.784 . . . . 0.28999999999999998 108.884 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.671 HD12 ' HA ' ' A' ' 91' ' ' ARG . 61.0 mt -60.48 -38.79 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 CA-C-N 115.139 -0.937 . . . . 0.23999999999999999 109.085 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.684 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -63.4 -34.31 77.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.487 -1.233 . . . . 0.33000000000000002 109.725 179.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.684 ' HD2' HD22 ' A' ' 95' ' ' ASN . 12.1 mptt -59.21 -45.26 91.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.657 -0.497 . . . . 1.6399999999999999 109.657 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.711 ' CD2' HD12 ' A' ' 70' ' ' LEU . 28.7 tp -64.52 -31.77 73.12 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 116.339 -0.392 . . . . 0.62 110.305 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.1 -51.2 70.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.217 -0.447 . . . . 1.8700000000000001 110.191 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' A' ' 102' ' ' ARG . 40.2 m-80 -72.65 -37.87 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.023 -0.535 . . . . 2.1200000000000001 111.016 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.573 HD22 ' HG ' ' A' ' 101' ' ' LEU . 0.0 OUTLIER -50.27 -45.54 54.44 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.499 -0.556 . . . . 0.26000000000000001 109.499 178.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.573 ' HG ' HD22 ' A' ' 100' ' ' ASN . 7.5 mt -66.82 -38.86 87.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.364 -0.835 . . . . 0.57999999999999996 109.14 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.574 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 48.6 mtt-85 -57.6 -35.12 70.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.427 -0.806 . . . . 2.0899999999999999 111.214 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -88.02 -18.47 28.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.169 0.509 . . . . 2.3199999999999998 109.845 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.59 ' HB3' HD23 ' A' ' 64' ' ' LEU . 14.9 tp -81.1 -34.67 32.46 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 114.092 1.145 . . . . 0.31 114.092 -178.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.597 ' H ' HE21 ' A' ' 105' ' ' GLN . 0.0 OUTLIER -73.73 165.44 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.103 -0.639 . . . . 2.04 110.457 -177.578 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.715 HG23 ' H ' ' A' ' 107' ' ' CYS . 1.5 tp -36.46 -75.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 112.64 0.608 . . . . 1.6899999999999999 112.64 -178.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.715 ' H ' HG23 ' A' ' 106' ' ' ILE . 0.0 OUTLIER 63.38 151.12 0.11 Allowed Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 110.48 -0.193 . . . . 2.4399999999999999 110.48 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.455 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 69.5 Cg_exo -49.91 -77.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.356 2.038 . . . . 3.0099999999999998 112.714 -179.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 178.59 22.06 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 4.4199999999999999 111.013 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.0 m -44.31 -37.66 3.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.882 -0.599 . . . . 5.4100000000000001 111.498 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -91.53 -34.03 14.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 5.8300000000000001 111.431 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 133.62 70.8 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.936 -0.649 . . . . 5.1600000000000001 112.239 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.4 m -80.36 101.47 8.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.771 0.32 . . . . 4.5499999999999998 111.585 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -161.99 162.13 33.91 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.1 -0.571 . . . . 4.4199999999999999 112.109 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.91 61.16 4.66 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.876 2.384 . . . . 5.5700000000000003 112.065 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -174.2 18.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 3.79 110.856 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -108.34 135.81 49.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.409 . . . . 2.6800000000000002 111.5 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 75.1 p -91.87 86.7 5.98 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-O 122.357 1.075 . . . . 2.4199999999999999 109.778 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.91 84.18 2.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.173 -1.831 . . . . 2.3500000000000001 111.425 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -96.79 144.25 26.94 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.731 -1.211 . . . . 2.1600000000000001 107.731 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.474 ' CD2' HD11 ' A' ' 104' ' ' LEU . 2.7 m-30 -107.34 41.87 1.42 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.673 -0.411 . . . . 0.46999999999999997 111.644 -177.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 93.6 p -83.08 -25.57 31.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.709 -0.478 . . . . 1.26 109.709 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -67.17 -31.07 71.23 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.32 -0.993 . . . . 2.5800000000000001 108.32 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.484 ' O ' HD12 ' A' ' 124' ' ' LEU . 2.2 tp -70.11 -22.95 62.97 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.155 -0.929 . . . . 0.26000000000000001 108.55 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.82 -49.67 19.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.066 -0.97 . . . . 1.3 110.069 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 m -67.12 -30.1 70.02 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.93 -0.577 . . . . 1.3999999999999999 110.486 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.5 m -65.56 -44.76 85.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.831 -0.622 . . . . 1.0900000000000001 111.11 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 43' ' ' THR . 41.7 t -61.64 -53.8 43.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.51000000000000001 111.32 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -51.87 -39.14 58.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.208 -0.451 . . . . 2.6899999999999999 111.118 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' HG13 ' A' ' 134' ' ' ILE . 0.9 OUTLIER -61.03 -50.8 71.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 2.1000000000000001 112.311 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.562 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.0 OUTLIER -55.18 -55.48 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.78 0.324 . . . . 0.28999999999999998 111.053 -178.826 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.1 t -53.48 -45.56 69.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 1.02 111.131 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.71 -34.0 50.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.004 0.372 . . . . 0.37 112.004 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 130' ' ' GLU . 52.6 mt -74.42 -51.23 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.661 0.615 . . . . 0.26000000000000001 112.661 -179.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.673 ' O ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -56.79 -35.51 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 112.517 0.562 . . . . 0.25 112.517 -178.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . 0.593 ' C ' ' HE ' ' A' ' 137' ' ' ARG . 41.1 mt-30 -67.99 -40.61 83.05 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.701 -0.4 . . . . 0.91000000000000003 110.307 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.627 ' HA ' ' HE ' ' A' ' 137' ' ' ARG . 0.1 OUTLIER -90.54 48.33 1.53 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 122.054 0.931 . . . . 4.0599999999999996 110.096 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.673 ' HB2' ' O ' ' A' ' 135' ' ' VAL . 1.1 tt -98.04 -91.48 0.26 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 113.787 -1.551 . . . . 1.8899999999999999 111.541 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.423 -0.798 . . . . 4.1699999999999999 111.161 179.791 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.694 0.283 . . . . 4.4699999999999998 111.0 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.28 -33.2 83.54 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.638 -0.792 . . . . 2.5 112.059 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.05 16.85 2.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.435 . . . . 2.0099999999999998 110.328 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.5 mm -143.69 90.27 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.201 0 CA-C-N 115.651 -0.704 . . . . 0.39000000000000001 110.726 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.5 p -129.22 -175.27 3.51 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.734 . . . . 0.35999999999999999 109.347 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.636 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -63.41 -30.99 72.02 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.203 -0.666 . . . . 0.98999999999999999 109.203 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.441 ' N ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.52 -47.81 79.98 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.134 -0.787 . . . . 0.14999999999999999 111.134 178.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 52.2 t -63.91 -40.3 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 CA-C-O 121.682 0.753 . . . . 1.28 109.25 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -39.84 86.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 114.339 -1.3 . . . . 0.17000000000000001 110.8 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.419 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 20.5 mt -65.81 -49.24 68.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.434 -0.348 . . . . 0.20999999999999999 110.422 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -54.38 -33.51 59.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.59 -0.522 . . . . 0.23999999999999999 109.59 178.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m -70.97 -41.72 70.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.561 -0.745 . . . . 0.34000000000000002 110.789 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.684 HG23 HD11 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -63.75 -33.2 75.13 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.948 0.404 . . . . 0.41999999999999998 110.703 179.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -72.74 -55.05 7.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 1.52 111.367 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.11 -47.51 23.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.28000000000000003 111.296 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.759 HD21 HD22 ' A' ' 70' ' ' LEU . 4.1 pp -71.08 -38.88 72.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.29999999999999999 110.08 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.438 ' N ' HD12 ' A' ' 46' ' ' LEU . 34.6 t -53.89 -52.27 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 0.23000000000000001 110.416 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mp -60.2 -35.03 74.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.033 -0.53 . . . . 1.2 110.003 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -60.23 -35.58 75.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.28000000000000003 109.75 178.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 46' ' ' LEU . 3.0 mt -69.56 -40.2 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 N-CA-C 109.027 -0.731 . . . . 0.20999999999999999 109.027 178.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.9 t -75.02 -9.38 58.48 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.022 -0.99 . . . . 0.45000000000000001 109.98 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.519 ' HG2' ' HB3' ' A' ' 58' ' ' ALA . 75.7 ttt180 -79.77 -40.85 27.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.543 -0.753 . . . . 2.9100000000000001 110.793 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.646 ' HB2' ' HB3' ' A' ' 59' ' ' SER . 24.6 t-20 -65.54 13.33 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.557 -0.292 . . . . 1.8799999999999999 111.657 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.492 ' H ' ' C ' ' A' ' 52' ' ' ARG . 47.2 t -100.87 -19.37 15.96 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.085 0.469 . . . . 2.2000000000000002 110.684 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.519 ' HB3' HE22 ' A' ' 56' ' ' GLN . 23.4 tt0 -109.97 -0.78 18.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.636 -0.711 . . . . 3.6800000000000002 109.823 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.519 HE22 ' HB3' ' A' ' 55' ' ' GLU . 0.4 OUTLIER 164.0 136.32 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.046 -0.979 . . . . 4.3099999999999996 108.96 -179.251 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.533 ' HA ' ' ND2' ' A' ' 53' ' ' ASN . 66.0 mtm -41.89 99.35 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.617 0.246 . . . . 3.8500000000000001 110.667 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.519 ' HB3' ' HG2' ' A' ' 52' ' ' ARG . . . -160.4 71.76 0.46 Allowed 'General case' 0 C--O 1.231 0.129 0 N-CA-C 113.053 0.76 . . . . 1.9199999999999999 113.053 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.646 ' HB3' ' HB2' ' A' ' 53' ' ' ASN . 51.4 p -165.22 -46.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.348 0.499 . . . . 2.2799999999999998 112.348 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 t-80 -48.74 -27.51 2.98 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.237 -0.585 . . . . 1.3 110.866 -177.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.2 p -97.12 -33.79 11.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.978 0.418 . . . . 1.5800000000000001 110.713 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.49 -55.06 4.93 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.491 0.923 . . . . 0.33000000000000002 113.491 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.548 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -64.85 -32.23 57.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 120.716 -0.394 . . . . 0.20999999999999999 110.834 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -70.76 -58.4 3.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.453 -0.339 . . . . 0.23999999999999999 111.192 178.623 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -58.59 -44.67 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.385 0.612 . . . . 2.3199999999999998 110.343 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.89 -26.51 63.26 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.343 -0.984 . . . . 0.28999999999999998 108.343 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.89 -46.64 91.08 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 114.835 -1.075 . . . . 0.40000000000000002 112.488 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -64.99 -42.91 94.1 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.881 0.372 . . . . 0.82999999999999996 110.826 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -58.09 -39.04 77.59 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.924 -0.58 . . . . 0.53000000000000003 110.777 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.759 HD22 HD21 ' A' ' 46' ' ' LEU . 10.6 tp -66.63 -50.58 62.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 1.4099999999999999 111.337 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.46 ' CD1' ' HB2' ' A' ' 98' ' ' GLU . 15.1 t80 -54.76 -35.75 64.11 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.083 -0.71 . . . . 0.75 109.083 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 t -67.14 -41.96 85.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.999 -1.0 . . . . 1.1299999999999999 111.848 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.4 -43.31 81.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 119.918 -0.713 . . . . 0.28000000000000003 110.47 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.483 ' HG ' ' HZ ' ' A' ' 90' ' ' PHE . 1.1 m -62.79 -22.89 66.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.90000000000000002 109.972 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.432 HG12 ' N ' ' A' ' 76' ' ' SER . 1.2 t -75.17 -45.72 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.576 -0.738 . . . . 0.42999999999999999 111.03 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.432 ' N ' HG12 ' A' ' 75' ' ' VAL . 49.1 m -83.87 -3.32 57.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 0.90000000000000002 110.665 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -96.38 -32.21 12.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.811 -0.631 . . . . 0.25 111.326 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 81' ' ' ILE . 2.4 m -67.86 -6.06 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.048 0.451 . . . . 0.97999999999999998 111.674 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -79.6 8.46 6.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.119 -0.491 . . . . 1.3100000000000001 110.084 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 t -127.64 -5.16 5.84 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.853 -0.612 . . . . 1.49 111.054 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.68 HG13 ' HG3' ' A' ' 87' ' ' LYS . 28.9 mm -31.75 -66.02 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.079 0 N-CA-C 112.417 0.525 . . . . 1.3899999999999999 112.417 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.563 ' HG3' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 77.49 -43.88 0.42 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.263 0.838 . . . . 2.5499999999999998 113.263 178.369 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.741 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 1.5 mt-30 -50.33 -26.39 4.8 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.039 0.755 . . . . 2.5600000000000001 113.039 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.5 ' C ' ' H ' ' A' ' 86' ' ' ASN . 27.6 mtm 74.47 -86.87 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.973 1.101 . . . . 2.71 113.973 177.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.403 ' H ' ' HB2' ' A' ' 84' ' ' MET . 15.4 ptm180 -64.75 6.36 0.23 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.963 0.411 . . . . 2.7799999999999998 111.722 -178.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.741 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -119.39 -12.51 9.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.528 0.68 . . . . 2.4900000000000002 109.407 -179.794 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.68 ' HG3' HG13 ' A' ' 81' ' ' ILE . 2.2 ttpp -57.8 -47.45 82.54 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.752 -1.113 . . . . 2.2799999999999998 110.751 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -55.82 -46.17 78.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.484 -0.78 . . . . 2.4900000000000002 110.75 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 92' ' ' GLU . . . -47.55 -70.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.412 0.523 . . . . 0.34999999999999998 112.412 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.588 ' CE1' HG22 ' A' ' 131' ' ' ILE . 63.7 t80 -62.47 -43.62 98.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.364 0.505 . . . . 0.28000000000000003 112.364 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.591 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 8.2 ttp180 -56.02 -62.14 1.91 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.617 -0.265 . . . . 3.3399999999999999 111.423 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -52.96 -33.1 49.51 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.522 -0.308 . . . . 2.5800000000000001 110.549 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -59.63 -39.94 85.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.478 0.656 . . . . 0.28999999999999998 109.703 178.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 90' ' ' PHE . 6.3 mt -64.25 -34.31 68.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 115.351 -0.84 . . . . 0.23999999999999999 109.471 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.666 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -63.41 -36.09 82.59 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.882 -1.054 . . . . 0.33000000000000002 109.308 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.666 ' HD2' HD22 ' A' ' 95' ' ' ASN . 0.8 OUTLIER -59.65 -47.63 84.87 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.213 -0.662 . . . . 1.6399999999999999 109.213 178.555 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.711 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.74 -39.75 85.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.512 -0.767 . . . . 0.62 109.832 178.452 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.46 ' HB2' ' CD1' ' A' ' 71' ' ' TYR . 8.6 tp10 -57.38 -58.01 10.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.466 -0.788 . . . . 1.8700000000000001 111.029 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.53 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 52.9 m-80 -61.79 -31.68 71.91 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.717 -0.475 . . . . 2.1200000000000001 109.717 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.779 ' ND2' HD23 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -63.14 -38.47 91.32 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.699 -0.852 . . . . 0.26000000000000001 108.699 178.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.779 HD23 ' ND2' ' A' ' 100' ' ' ASN . 8.9 mt -67.39 -41.7 84.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.159 -1.052 . . . . 0.57999999999999996 108.159 177.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.619 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 71.3 mtp180 -56.27 -38.59 71.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.242 -1.344 . . . . 2.0899999999999999 111.549 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -89.45 -17.77 28.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.035 -0.529 . . . . 2.3199999999999998 111.743 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.43 HD11 ' CD2' ' A' ' 121' ' ' PHE . 16.5 tp -86.13 -25.31 25.83 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.935 1.087 . . . . 0.31 113.935 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.783 ' H ' HE21 ' A' ' 105' ' ' GLN . 0.0 OUTLIER -68.63 162.54 25.72 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.554 -0.458 . . . . 2.04 110.451 -178.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.629 HG23 ' H ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -26.72 -63.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 113.541 0.941 . . . . 1.6899999999999999 113.541 -178.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.629 ' H ' HG23 ' A' ' 106' ' ' ILE . 7.5 t 60.02 144.24 0.05 OUTLIER Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 120.81 0.338 . . . . 2.4399999999999999 111.51 -179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.471 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 42.6 Cg_exo -55.07 -73.99 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.51 2.14 . . . . 3.0099999999999998 112.564 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -171.63 22.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 4.4199999999999999 110.731 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -45.71 -34.33 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.53 -0.759 . . . . 5.4100000000000001 111.869 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.98 131.78 10.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.875 0.369 . . . . 5.8300000000000001 111.705 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 56.1 26.21 48.77 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.912 -0.586 . . . . 5.1600000000000001 112.941 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 m 51.48 -99.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 4.5499999999999998 111.295 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -150.77 -112.16 0.56 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.817 -0.706 . . . . 4.4199999999999999 112.53 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.75 -169.78 0.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.217 1.944 . . . . 5.5700000000000003 112.373 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 58.87 61.84 2.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.165 -0.47 . . . . 3.79 111.544 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -167.69 -75.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.435 -0.348 . . . . 2.6800000000000002 111.397 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.0 t 173.11 119.01 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.91 -0.586 . . . . 2.4199999999999999 110.814 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 17.9 mm-40 -108.3 82.17 1.59 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.816 -0.629 . . . . 2.3500000000000001 110.577 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -106.77 92.26 4.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.307 -0.86 . . . . 2.1600000000000001 109.948 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.467 ' HB2' HG21 ' A' ' 50' ' ' ILE . 1.4 m-30 -94.36 42.56 1.09 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.507 . . . . 0.46999999999999997 111.448 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.4 m -67.06 -21.54 65.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 1.26 110.363 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.426 ' HB2' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -65.67 -42.14 91.67 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.348 -0.612 . . . . 2.5800000000000001 109.348 178.864 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.605 HD13 ' ND2' ' A' ' 100' ' ' ASN . 2.4 tp -60.79 -26.51 67.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.858 -0.793 . . . . 0.26000000000000001 108.858 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 tp -70.25 -49.07 53.71 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.232 -0.895 . . . . 1.3 109.933 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -63.19 -36.15 82.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.886 -0.597 . . . . 1.3999999999999999 110.482 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 131' ' ' ILE . 74.0 m -59.72 -42.56 93.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.833 -0.622 . . . . 1.0900000000000001 110.729 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 41.8 t -60.32 -53.11 53.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.053 -0.521 . . . . 0.51000000000000001 111.019 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -50.67 -43.32 57.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 2.6899999999999999 111.33 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.81 -56.35 22.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 2.1000000000000001 112.209 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.588 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -50.34 -55.7 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 121.018 -0.273 . . . . 0.28999999999999998 111.179 -178.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 56.7 p -55.25 -46.26 76.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.94 0.4 . . . . 1.02 110.405 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.571 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 23.6 t70 -53.51 -21.82 7.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.089 -0.505 . . . . 0.37 111.89 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 70.1 mt -88.34 -48.39 14.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.643 0.609 . . . . 0.26000000000000001 112.643 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.636 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -59.91 -50.34 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 114.371 1.248 . . . . 0.25 114.371 -177.693 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . 0.699 ' HB2' ' NH2' ' A' ' 137' ' ' ARG . 44.3 mt-30 -44.37 -56.21 4.39 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.134 0.42 . . . . 0.91000000000000003 112.134 -177.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.699 ' NH2' ' HB2' ' A' ' 136' ' ' GLN . 0.0 OUTLIER -70.19 -37.45 75.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.273 0.559 . . . . 4.0599999999999996 109.518 178.459 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' A' ' 135' ' ' VAL . 4.9 tp -52.98 -76.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.984 -1.007 . . . . 1.8899999999999999 110.89 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.541 ' HG3' ' HG ' ' A' ' 138' ' ' LEU . 42.6 mt-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.271 -0.871 . . . . 4.1699999999999999 110.824 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.689 0.281 . . . . 4.4699999999999998 110.93 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 53.13 35.53 49.63 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.817 -0.706 . . . . 2.5 112.262 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 43.51 34.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.173 0.435 . . . . 2.0099999999999998 112.173 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.656 ' HA ' HG11 ' A' ' 38' ' ' VAL . 40.5 mm 64.41 109.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.947 -0.57 . . . . 0.39000000000000001 112.023 179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.49 ' H ' HG12 ' A' ' 38' ' ' VAL . 81.9 p -126.57 -159.57 0.93 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.441 -0.799 . . . . 0.35999999999999999 109.614 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.599 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -74.45 -27.76 60.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.718 -0.475 . . . . 0.98999999999999999 109.718 178.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.55 -47.96 82.26 Favored Glycine 0 N--CA 1.453 -0.188 0 CA-C-N 115.642 -0.708 . . . . 0.14999999999999999 112.021 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.656 HG11 ' HA ' ' A' ' 34' ' ' ILE . 12.4 p -66.68 -37.69 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.518 0.675 . . . . 1.28 109.366 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.438 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.1 t -63.51 -41.48 92.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.622 -1.172 . . . . 0.17000000000000001 110.962 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.425 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 31.4 mt -65.23 -51.29 61.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.789 0.328 . . . . 0.20999999999999999 110.285 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -52.28 -31.41 32.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.152 0.501 . . . . 0.23999999999999999 109.765 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.3 m -73.14 -42.41 62.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.415 -0.811 . . . . 0.34000000000000002 111.093 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.667 HG23 HD11 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -63.01 -35.47 80.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.338 . . . . 0.41999999999999998 111.184 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -72.95 -53.8 10.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 1.52 111.508 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -47.58 -47.86 28.35 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.348 -0.387 . . . . 0.28000000000000003 111.69 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.685 HD21 HD22 ' A' ' 70' ' ' LEU . 4.0 pp -70.67 -39.63 73.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.483 -0.326 . . . . 0.29999999999999999 110.172 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.442 ' N ' HD12 ' A' ' 46' ' ' LEU . 47.2 t -55.25 -37.98 67.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.23000000000000001 109.93 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.67 -36.25 78.28 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.661 -0.7 . . . . 1.2 109.717 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.74 77.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.605 -0.517 . . . . 0.28000000000000003 109.605 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.534 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -71.96 -27.37 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 N-CA-C 108.779 -0.823 . . . . 0.20999999999999999 108.779 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.3 t -83.72 -14.82 50.73 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.18 -0.918 . . . . 0.45000000000000001 109.696 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.461 ' HA ' HE22 ' A' ' 56' ' ' GLN . 42.7 mtp180 -90.78 -18.36 25.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.588 -0.733 . . . . 2.9100000000000001 111.323 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -83.62 9.59 11.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 1.8799999999999999 110.504 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.2 p -130.28 -25.06 2.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 2.2000000000000002 110.884 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.41 ' HB2' ' NE2' ' A' ' 56' ' ' GLN . 13.8 mm-40 -100.58 -18.85 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 3.6800000000000002 111.129 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.471 HE21 ' N ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER -144.95 3.34 1.06 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.362 -0.381 . . . . 4.3099999999999996 111.676 -179.82 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 60.7 mtt 52.2 48.45 22.65 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.489 -0.323 . . . . 3.8500000000000001 110.758 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.33 -89.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 1.9199999999999999 111.716 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.9 p -176.24 143.58 0.53 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 2.2799999999999998 111.06 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -72.13 -19.82 61.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.512 . . . . 1.3 109.989 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -78.34 -9.02 59.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.662 -0.699 . . . . 1.5800000000000001 110.539 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.67 -45.81 23.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.33000000000000002 110.403 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.534 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -76.19 -27.9 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.718 -0.673 . . . . 0.20999999999999999 109.974 179.006 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.614 HD21 ' NE2' ' A' ' 105' ' ' GLN . 2.1 tm? -73.9 -52.45 12.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.35 -0.841 . . . . 0.23999999999999999 110.793 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -60.23 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.484 0.659 . . . . 2.3199999999999998 109.463 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.99 -27.9 67.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.064 -0.971 . . . . 0.28999999999999998 108.419 178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.78 -47.31 87.48 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.874 -1.057 . . . . 0.40000000000000002 112.154 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -38.14 86.14 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.057 0.456 . . . . 0.82999999999999996 110.098 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 69' ' ' ASN . 0.9 OUTLIER -60.22 -46.03 91.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.658 -0.701 . . . . 0.53000000000000003 110.5 179.685 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.685 HD22 HD21 ' A' ' 46' ' ' LEU . 14.4 tp -57.99 -48.41 80.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.766 -0.652 . . . . 1.4099999999999999 110.689 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.476 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 23.8 t80 -59.22 -34.98 72.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.201 -0.454 . . . . 0.75 110.059 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 t -76.46 -19.33 58.14 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.85 -0.614 . . . . 1.1299999999999999 112.009 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -84.71 -44.64 13.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.789 -0.819 . . . . 0.28000000000000003 108.789 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 4.3 m -69.44 -20.33 63.77 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.643 -0.708 . . . . 0.90000000000000002 109.09 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.476 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.8 OUTLIER -72.96 -45.37 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-N 115.617 -0.719 . . . . 0.42999999999999999 110.364 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.423 ' N ' HG12 ' A' ' 75' ' ' VAL . 43.7 t -81.17 -11.06 59.52 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 121.064 0.459 . . . . 0.90000000000000002 110.357 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.481 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.5 OUTLIER -93.57 -29.19 15.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.668 -0.696 . . . . 0.25 110.407 179.713 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.568 HG21 ' HG2' ' A' ' 91' ' ' ARG . 0.3 OUTLIER -62.1 -30.05 47.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.846 -0.615 . . . . 0.97999999999999998 111.858 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.87 -4.45 20.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.067 0.461 . . . . 1.3100000000000001 110.297 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -104.87 7.07 34.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.688 -0.687 . . . . 1.49 111.444 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.602 ' HB ' ' HD2' ' A' ' 87' ' ' LYS . 5.5 mm -70.11 95.92 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.868 0.366 . . . . 1.3899999999999999 110.952 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.612 ' O ' ' HG2' ' A' ' 84' ' ' MET . 0.0 OUTLIER -80.91 -26.04 37.08 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.76 -0.83 . . . . 2.5499999999999998 108.76 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.841 ' HB3' ' ND2' ' A' ' 86' ' ' ASN . 5.7 mm100 -37.63 -41.65 0.49 Allowed 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.201 -1.363 . . . . 2.5600000000000001 113.9 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.612 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 19.1 mmt 82.09 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.856 1.058 . . . . 2.71 113.856 178.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -71.74 29.92 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.976 0.417 . . . . 2.7799999999999998 111.3 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.841 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -138.8 -23.94 0.93 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.891 -0.595 . . . . 2.4900000000000002 110.795 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 5.4 mtmt -39.13 -54.52 1.74 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.859 -0.61 . . . . 2.2799999999999998 111.045 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.405 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 88.5 m-85 -55.34 -48.94 73.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.534 -0.757 . . . . 2.4900000000000002 111.453 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.435 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -47.03 -69.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.909 0.337 . . . . 0.34999999999999998 111.909 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.592 ' CE2' HG22 ' A' ' 131' ' ' ILE . 33.4 t80 -60.05 -44.55 94.61 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.184 0.438 . . . . 0.28000000000000003 112.184 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.626 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -55.1 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.585 0.231 . . . . 3.3399999999999999 111.387 -178.337 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 12.1 pt-20 -50.82 -36.74 38.88 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.333 -0.394 . . . . 2.5800000000000001 110.235 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 90' ' ' PHE . . . -59.11 -39.63 82.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.125 0.488 . . . . 0.28999999999999998 109.822 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 90' ' ' PHE . 9.1 mt -62.97 -38.97 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.23999999999999999 109.396 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.527 ' ND2' ' N ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -57.57 -43.62 84.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.834 -1.075 . . . . 0.33000000000000002 110.045 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.527 ' N ' ' ND2' ' A' ' 95' ' ' ASN . 0.1 OUTLIER -56.42 -50.36 71.86 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.336 -0.393 . . . . 1.6399999999999999 110.264 179.159 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.785 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -54.93 -41.62 71.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.816 -0.629 . . . . 0.62 109.804 178.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 95' ' ' ASN . 7.8 tp10 -57.1 -59.97 4.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.443 -0.799 . . . . 1.8700000000000001 110.881 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -66.72 -9.33 35.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 2.1200000000000001 110.227 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.779 HD22 HD23 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -85.13 -37.73 19.89 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.516 -1.29 . . . . 0.26000000000000001 107.516 178.773 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.785 HD21 ' CD1' ' A' ' 97' ' ' LEU . 7.6 mt -67.75 -39.88 84.16 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.416 -1.327 . . . . 0.57999999999999996 107.416 177.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.612 ' O ' ' HB2' ' A' ' 105' ' ' GLN . 75.1 mtt180 -55.9 -53.52 55.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.293 -1.321 . . . . 2.0899999999999999 110.686 178.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -68.93 -23.89 64.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.709 -0.478 . . . . 2.3199999999999998 109.709 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.402 HD23 HD23 ' A' ' 64' ' ' LEU . 38.6 tp -76.13 -17.54 59.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.621 -0.718 . . . . 0.31 110.339 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.614 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -50.98 166.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.68 -0.691 . . . . 2.04 110.398 179.252 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.491 HG23 ' N ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -43.14 -49.99 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.589 -0.278 . . . . 1.6899999999999999 111.285 -179.54 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.491 ' N ' HG23 ' A' ' 106' ' ' ILE . 33.8 t 62.23 137.39 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-O 121.617 0.722 . . . . 2.4399999999999999 112.222 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.447 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 43.2 Cg_endo -76.68 -80.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 123.671 2.914 . . . . 3.0099999999999998 112.806 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.493 ' HB1' ' O ' ' A' ' 112' ' ' GLY . . . -177.66 14.71 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.815 -1.084 . . . . 4.4199999999999999 108.944 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.545 HG22 ' O ' ' A' ' 110' ' ' THR . 18.0 m 21.92 77.58 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.329 -1.305 . . . . 5.4100000000000001 112.146 -177.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 61.06 103.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.934 -1.03 . . . . 5.8300000000000001 111.734 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . 0.493 ' O ' ' HB1' ' A' ' 109' ' ' ALA . . . 62.53 -130.28 43.24 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.922 -0.656 . . . . 5.1600000000000001 112.863 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.6 t -167.97 -169.64 1.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.687 0.279 . . . . 4.5499999999999998 110.495 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -158.12 -95.17 0.11 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.823 -0.703 . . . . 4.4199999999999999 111.639 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' A' ' 116' ' ' ALA . 25.8 Cg_exo -61.95 -67.99 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 121.815 1.677 . . . . 5.5700000000000003 110.953 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 115' ' ' PRO . . . 170.12 -70.78 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.63 -0.714 . . . . 3.79 110.696 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -145.46 -59.66 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 2.6800000000000002 110.783 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 44.7 p 55.92 110.97 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.367 0.603 . . . . 2.4199999999999999 111.573 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -124.22 82.77 2.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.442 -0.799 . . . . 2.3500000000000001 111.071 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -139.08 81.63 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.452 -0.794 . . . . 2.1600000000000001 108.916 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.483 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 0.7 OUTLIER -79.48 53.13 1.49 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.497 -0.774 . . . . 0.46999999999999997 112.176 -177.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 88.6 p -75.68 -16.7 60.14 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.737 -0.468 . . . . 1.26 109.737 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.433 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 3.4 mppt? -69.9 -41.91 74.08 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.049 -0.722 . . . . 2.5800000000000001 109.049 178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.704 HD13 ' ND2' ' A' ' 100' ' ' ASN . 1.3 tp -61.63 -25.31 67.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.575 -0.898 . . . . 0.26000000000000001 108.575 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.29 -48.7 49.1 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.007 -0.997 . . . . 1.3 109.925 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 50.7 m -63.43 -35.75 81.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.754 -0.657 . . . . 1.3999999999999999 110.51 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 131' ' ' ILE . 39.9 t -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 1.0900000000000001 110.74 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.601 HG22 HG22 ' A' ' 43' ' ' THR . 17.9 t -60.87 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 0.51000000000000001 111.124 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -54.57 -38.28 66.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.577 -0.738 . . . . 2.6899999999999999 112.073 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -60.86 -56.17 24.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.474 0.546 . . . . 2.1000000000000001 112.474 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.592 HG22 ' CE2' ' A' ' 90' ' ' PHE . 1.3 mt -52.68 -54.15 17.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 121.078 0.466 . . . . 0.28999999999999998 110.811 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.5 t -53.45 -47.91 69.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.762 -0.653 . . . . 1.02 111.18 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.403 ' C ' HH21 ' A' ' 137' ' ' ARG . 17.0 t70 -58.16 -25.81 61.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.37 111.626 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.597 HG22 HD13 ' A' ' 138' ' ' LEU . 78.1 mt -73.33 -51.88 23.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.039 0.385 . . . . 0.26000000000000001 112.039 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.599 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -62.19 -35.94 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 112.309 0.485 . . . . 0.25 112.309 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.34 -60.34 3.07 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.981 -0.288 . . . . 0.91000000000000003 111.231 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.492 ' NE ' ' HA ' ' A' ' 134' ' ' ILE . 0.0 OUTLIER -67.84 -12.37 60.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.179 0.514 . . . . 4.0599999999999996 110.114 179.402 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.597 HD13 HG22 ' A' ' 134' ' ' ILE . 5.2 tp -52.14 -81.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.535 -0.757 . . . . 1.8899999999999999 111.122 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.65 -0.69 . . . . 4.1699999999999999 111.169 179.988 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 95.9 p . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 120.662 0.268 . . . . 4.4699999999999998 111.408 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.49 -41.21 98.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.235 -0.983 . . . . 2.5 111.258 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.01 12.72 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 2.0099999999999998 109.718 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.788 ' HA ' HG11 ' A' ' 38' ' ' VAL . 37.1 mm -141.92 90.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.411 -0.813 . . . . 0.39000000000000001 111.091 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.609 ' O ' HG12 ' A' ' 38' ' ' VAL . 73.9 p -125.65 -158.98 0.87 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.766 -0.828 . . . . 0.35999999999999999 108.766 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.564 ' HB2' HG21 ' A' ' 135' ' ' VAL . 6.1 ttpt -66.5 -35.93 81.48 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.91 -0.716 . . . . 0.98999999999999999 109.141 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.21 -49.37 63.78 Favored Glycine 0 N--CA 1.452 -0.237 0 CA-C-N 114.989 -1.005 . . . . 0.14999999999999999 113.005 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.788 HG11 ' HA ' ' A' ' 34' ' ' ILE . 9.7 p -65.26 -37.81 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.205 0 CA-C-O 121.467 0.651 . . . . 1.28 109.866 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.486 ' O ' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -65.03 -36.31 77.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 114.671 -1.15 . . . . 0.17000000000000001 111.08 -179.753 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.468 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 26.8 mt -71.13 -51.54 24.41 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.916 -0.314 . . . . 0.20999999999999999 110.548 178.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -54.04 -34.18 59.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.23999999999999999 109.801 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.623 ' CB ' HD23 ' A' ' 70' ' ' LEU . 65.9 m -73.62 -44.16 57.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.401 -0.818 . . . . 0.34000000000000002 111.179 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.67 HG23 HD21 ' A' ' 70' ' ' LEU . 0.8 OUTLIER -64.25 -31.44 72.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.986 0.422 . . . . 0.41999999999999998 110.566 178.622 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -72.46 -54.94 7.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.826 -0.625 . . . . 1.52 111.06 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.79 -47.33 20.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.115 -0.493 . . . . 0.28000000000000003 111.382 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.466 ' O ' HG13 ' A' ' 50' ' ' ILE . 4.1 pp -72.11 -38.83 69.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.827 -0.349 . . . . 0.29999999999999999 110.355 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.453 ' N ' HD12 ' A' ' 46' ' ' LEU . 41.4 t -55.35 -37.65 67.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.23000000000000001 110.249 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.96 -38.82 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.923 -0.58 . . . . 1.2 110.0 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.38 -46.3 76.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.717 -0.475 . . . . 0.28000000000000003 109.717 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.615 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.6 mt -62.3 -39.74 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.817 -0.809 . . . . 0.20999999999999999 108.817 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.0 t -61.43 -17.04 52.47 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.585 -0.895 . . . . 0.45000000000000001 108.585 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.454 ' O ' ' N ' ' A' ' 54' ' ' SER . 42.3 mtt180 -106.38 -106.62 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.854 -1.066 . . . . 2.9100000000000001 110.923 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.494 HD21 ' HB3' ' A' ' 62' ' ' ALA . 10.5 m120 41.35 18.86 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.036 0.446 . . . . 1.8799999999999999 111.834 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.454 ' N ' ' O ' ' A' ' 52' ' ' ARG . 46.9 m -152.13 -16.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.771 -0.65 . . . . 2.2000000000000002 109.895 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.554 ' HB2' HE22 ' A' ' 56' ' ' GLN . 11.7 mm-40 -61.94 -26.56 68.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.594 -0.73 . . . . 3.6800000000000002 110.333 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.708 HE21 ' H ' ' A' ' 57' ' ' MET . 0.7 OUTLIER -172.86 -58.29 0.02 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.217 -0.447 . . . . 4.3099999999999996 111.087 179.46 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.708 ' H ' HE21 ' A' ' 56' ' ' GLN . 59.0 mtt -146.04 -113.49 0.09 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.406 -0.361 . . . . 3.8500000000000001 110.15 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.453 ' O ' ' HB3' ' A' ' 59' ' ' SER . . . 72.57 -47.75 0.67 Allowed 'General case' 0 CA--C 1.518 -0.283 0 O-C-N 123.339 0.4 . . . . 1.9199999999999999 112.0 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 58' ' ' ALA . 6.2 t 64.91 164.36 0.15 Allowed 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.823 0.345 . . . . 2.2799999999999998 111.664 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 -63.54 -18.06 63.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.466 -0.568 . . . . 1.3 109.466 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.8 m -70.88 -8.25 51.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.473 -0.785 . . . . 1.5800000000000001 110.335 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.494 ' HB3' HD21 ' A' ' 53' ' ' ASN . . . -79.59 -47.17 15.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.155 0.502 . . . . 0.33000000000000002 109.996 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.615 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.98 -28.79 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.449 -0.796 . . . . 0.20999999999999999 109.775 178.832 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.632 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.0 OUTLIER -73.86 -51.49 16.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.132 -0.94 . . . . 0.23999999999999999 111.015 179.002 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.48 -50.72 70.3 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.242 0.544 . . . . 2.3199999999999998 109.723 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.74 -26.91 67.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.375 -0.972 . . . . 0.28999999999999998 108.375 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.452 ' HA2' HD22 ' A' ' 46' ' ' LEU . . . -64.14 -46.48 90.97 Favored Glycine 0 N--CA 1.442 -0.906 0 CA-C-N 114.865 -1.061 . . . . 0.40000000000000002 112.324 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.18 -41.83 99.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.74 0.305 . . . . 0.82999999999999996 110.687 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.477 ' O ' ' HB3' ' A' ' 72' ' ' SER . 16.7 m-80 -58.42 -40.46 82.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.53000000000000003 110.995 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.67 HD21 HG23 ' A' ' 43' ' ' THR . 2.6 tm? -65.35 -50.47 65.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 1.4099999999999999 110.865 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.447 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 12.6 t80 -56.44 -29.86 62.15 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.375 -0.972 . . . . 0.75 108.375 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 32.8 t -67.73 -53.35 28.16 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 114.927 -1.033 . . . . 1.1299999999999999 111.112 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.03 -43.62 95.18 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.306 -0.558 . . . . 0.28000000000000003 111.715 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -52.09 67.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.927 0.394 . . . . 0.90000000000000002 110.904 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -55.45 -33.92 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.42999999999999999 112.871 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 44.5 t -90.92 -13.36 33.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.038 0.447 . . . . 0.90000000000000002 110.794 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.487 ' HB2' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -88.24 -24.2 23.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.684 -0.689 . . . . 0.25 111.379 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.7 m -69.8 -12.89 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.97999999999999998 111.374 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -68.59 -5.64 21.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 1.3100000000000001 110.355 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.8 m -118.36 6.89 11.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.854 -0.612 . . . . 1.49 111.449 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.51 ' CG2' HD21 ' A' ' 86' ' ' ASN . 1.0 OUTLIER -47.68 -24.95 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.211 0.448 . . . . 1.3899999999999999 112.211 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.557 HE21 ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 64.32 -70.38 0.08 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.144 0.497 . . . . 2.5499999999999998 110.276 -177.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.646 HE21 ' H ' ' A' ' 84' ' ' MET . 2.3 mm100 -51.8 173.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.122 -0.945 . . . . 2.5600000000000001 109.801 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.646 ' H ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -140.42 -20.22 0.85 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.46 -0.496 . . . . 2.71 111.418 -178.196 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -95.34 15.86 18.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.857 -0.794 . . . . 2.7799999999999998 108.857 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.765 HD22 ' H ' ' A' ' 86' ' ' ASN . 0.1 OUTLIER -128.87 -30.88 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.863 -1.062 . . . . 2.4900000000000002 110.863 -179.029 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.65 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 11.1 tttm -42.37 -52.23 4.64 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.878 -0.601 . . . . 2.2799999999999998 111.916 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -55.04 -45.89 75.28 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.846 -0.341 . . . . 2.4900000000000002 110.827 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -50.58 -71.0 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.914 0.387 . . . . 0.34999999999999998 111.987 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.583 ' CE1' HG22 ' A' ' 131' ' ' ILE . 71.4 t80 -61.37 -46.02 91.92 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.476 0.547 . . . . 0.28000000000000003 112.476 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.65 ' HB2' ' O ' ' A' ' 87' ' ' LYS . 0.1 OUTLIER -56.48 -57.96 10.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.536 0.207 . . . . 3.3399999999999999 111.235 -178.084 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 8.7 pt-20 -50.3 -37.64 37.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.4 -0.364 . . . . 2.5800000000000001 110.165 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -60.0 -41.66 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.38 0.61 . . . . 0.28999999999999998 109.569 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.576 HD11 ' CE2' ' A' ' 90' ' ' PHE . 17.8 mt -62.48 -42.97 97.78 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.433 -0.803 . . . . 0.23999999999999999 109.328 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.643 HD22 ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -55.7 -38.9 70.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.86 -1.064 . . . . 0.33000000000000002 109.371 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.643 ' HD2' HD22 ' A' ' 95' ' ' ASN . 1.1 mptm? -57.17 -46.98 82.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.978 -0.556 . . . . 1.6399999999999999 109.956 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.588 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 33.2 tp -58.96 -36.15 74.34 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 120.956 0.408 . . . . 0.62 110.147 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 102' ' ' ARG . 0.7 OUTLIER -57.24 -59.08 5.64 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.871 -0.604 . . . . 1.8700000000000001 110.169 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 102' ' ' ARG . 34.1 m-80 -71.31 -10.06 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.853 -0.612 . . . . 2.1200000000000001 111.032 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.503 ' ND2' HD13 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -79.47 -47.95 14.75 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 108.58 -0.896 . . . . 0.26000000000000001 108.58 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 97' ' ' LEU . 7.5 mt -64.44 -33.86 76.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.393 -0.966 . . . . 0.57999999999999996 108.393 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 81.4 mtt180 -55.04 -55.68 28.3 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 114.944 -1.025 . . . . 2.0899999999999999 110.899 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -73.1 -19.69 61.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.022 0.439 . . . . 2.3199999999999998 110.47 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.556 HD23 HD23 ' A' ' 64' ' ' LEU . 51.6 tp -76.27 -16.94 59.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.769 -0.65 . . . . 0.31 111.286 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.632 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -52.03 167.45 0.12 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.374 -0.376 . . . . 2.04 111.232 -179.773 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.512 HG23 ' H ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -56.83 -56.48 14.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.21 -0.45 . . . . 1.6899999999999999 111.429 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.512 ' H ' HG23 ' A' ' 106' ' ' ILE . 6.7 t 59.93 143.92 0.05 OUTLIER Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 120.946 0.403 . . . . 2.4399999999999999 111.844 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.47 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 52.3 Cg_exo -53.14 -73.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.683 2.255 . . . . 3.0099999999999998 112.879 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -148.94 -13.73 0.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 4.4199999999999999 111.297 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.7 m -54.54 -27.56 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.254 -0.43 . . . . 5.4100000000000001 111.182 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -50.42 73.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 5.8300000000000001 111.188 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 166.66 74.28 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 5.1600000000000001 112.659 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.2 t -96.77 110.88 23.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.674 0.273 . . . . 4.5499999999999998 111.081 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -167.76 -94.67 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.56 -0.828 . . . . 4.4199999999999999 112.755 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.16 -46.56 32.0 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.337 2.025 . . . . 5.5700000000000003 112.296 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -166.71 -65.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 3.79 111.072 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -161.74 -40.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 2.6800000000000002 111.3 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 73.0 p 51.61 106.42 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.295 0.569 . . . . 2.4199999999999999 111.686 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -134.2 85.94 2.23 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.518 -0.765 . . . . 2.3500000000000001 111.314 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -119.54 89.53 3.15 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.541 -1.208 . . . . 2.1600000000000001 109.188 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.467 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -93.3 42.55 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.025 -0.534 . . . . 0.46999999999999997 112.027 -178.109 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 80.2 p -69.75 -17.05 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.676 -0.41 . . . . 1.26 110.014 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -48.21 68.13 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.651 -0.87 . . . . 2.5800000000000001 108.651 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.522 ' O ' HD12 ' A' ' 124' ' ' LEU . 1.5 tp -54.24 -25.76 24.98 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.214 -0.903 . . . . 0.26000000000000001 109.251 177.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tp -70.78 -48.41 54.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.328 -0.851 . . . . 1.3 110.247 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.5 p -66.85 -35.04 79.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.126 -0.488 . . . . 1.3999999999999999 111.116 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 26.0 t -62.77 -42.53 99.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 1.0900000000000001 111.302 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 124' ' ' LEU . 42.6 t -63.14 -50.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.113 -0.494 . . . . 0.51000000000000001 110.852 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -53.19 -37.65 62.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.89 -0.595 . . . . 2.6899999999999999 110.548 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.415 ' O ' HG13 ' A' ' 134' ' ' ILE . 37.5 tt0 -60.46 -56.43 21.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.712 -0.677 . . . . 2.1000000000000001 112.32 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.583 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -52.62 -55.74 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.95 0.405 . . . . 0.28999999999999998 111.187 -178.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.414 ' OG ' ' NE2' ' A' ' 136' ' ' GLN . 7.5 t -54.13 -45.57 71.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.61 . . . . 1.02 111.353 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.45 -26.06 64.9 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.151 0.426 . . . . 0.37 112.151 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.508 ' O ' ' HB2' ' A' ' 138' ' ' LEU . 81.3 mt -75.5 -52.51 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 112.041 0.386 . . . . 0.26000000000000001 112.041 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.564 HG21 ' HB2' ' A' ' 36' ' ' LYS . 1.4 p -59.67 -37.45 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 112.537 0.569 . . . . 0.25 112.537 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . 0.581 ' C ' ' HE ' ' A' ' 137' ' ' ARG . 66.9 mt-30 -70.06 -56.29 7.29 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.75 -0.38 . . . . 0.91000000000000003 110.711 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.609 ' CA ' ' HE ' ' A' ' 137' ' ' ARG . 0.1 OUTLIER -87.02 51.62 2.3 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 122.267 1.032 . . . . 4.0599999999999996 109.688 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.518 ' HB3' ' O ' ' A' ' 135' ' ' VAL . 1.9 tp -117.07 -78.73 0.58 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.382 -1.735 . . . . 1.8899999999999999 110.762 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.57 -0.729 . . . . 4.1699999999999999 111.776 179.864 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 38.5 p . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.704 0.288 . . . . 4.4699999999999998 111.015 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 54.47 47.35 69.86 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.742 -0.742 . . . . 2.5 112.118 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 45.89 26.97 0.43 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.894 0.378 . . . . 2.0099999999999998 111.914 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.659 ' HA ' HG11 ' A' ' 38' ' ' VAL . 44.2 mm 64.32 108.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.671 -0.695 . . . . 0.39000000000000001 112.215 178.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.518 ' O ' HG12 ' A' ' 38' ' ' VAL . 81.9 p -123.08 -160.46 0.9 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.266 -0.879 . . . . 0.35999999999999999 109.09 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.666 ' HG3' HG21 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -75.28 -30.52 60.46 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.177 -0.609 . . . . 0.98999999999999999 109.408 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.83 -47.61 89.61 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.418 -0.81 . . . . 0.14999999999999999 111.827 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.659 HG11 ' HA ' ' A' ' 34' ' ' ILE . 13.9 p -67.09 -37.97 80.32 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-O 121.455 0.645 . . . . 1.28 109.34 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.442 ' N ' HG13 ' A' ' 38' ' ' VAL . 1.7 t -60.52 -42.79 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 114.747 -1.115 . . . . 0.17000000000000001 111.17 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.455 ' HA ' ' OG1' ' A' ' 43' ' ' THR . 36.0 mt -67.11 -51.51 53.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.243 -0.28 . . . . 0.20999999999999999 110.243 178.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -52.78 -30.94 35.84 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.178 -0.675 . . . . 0.23999999999999999 109.178 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.503 ' HB2' ' CD2' ' A' ' 70' ' ' LEU . 66.2 m -73.16 -52.67 13.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.177 -0.92 . . . . 0.34000000000000002 110.664 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.66 HG23 HD21 ' A' ' 70' ' ' LEU . 0.7 OUTLIER -55.62 -29.37 59.05 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.88 0.371 . . . . 0.41999999999999998 110.87 178.429 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -75.07 -51.86 12.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.102 -0.499 . . . . 1.52 110.661 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -48.23 -46.78 35.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.97 -0.559 . . . . 0.28000000000000003 110.992 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 50' ' ' ILE . 3.9 pp -72.71 -40.66 65.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.325 -0.398 . . . . 0.29999999999999999 110.173 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.458 ' N ' HD12 ' A' ' 46' ' ' LEU . 44.0 t -54.15 -36.21 63.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.089 0.471 . . . . 0.23000000000000001 110.001 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.78 -34.49 64.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 1.2 109.793 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.02 -36.13 76.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.487 -0.56 . . . . 0.28000000000000003 109.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.545 HG12 ' HB ' ' A' ' 63' ' ' VAL . 1.1 mt -72.81 -32.3 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 N-CA-C 108.496 -0.927 . . . . 0.20999999999999999 108.496 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.3 t -76.97 -15.29 59.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.118 -0.946 . . . . 0.45000000000000001 109.389 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.516 ' HA ' ' NE2' ' A' ' 56' ' ' GLN . 95.2 mtt180 -87.71 -15.32 37.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.512 -0.767 . . . . 2.9100000000000001 110.934 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.501 HD22 ' N ' ' A' ' 59' ' ' SER . 5.9 t-20 -101.43 4.54 41.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 1.8799999999999999 110.453 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 52.8 m -112.63 -37.06 5.02 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.137 -0.483 . . . . 2.2000000000000002 111.418 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -105.33 -3.56 22.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.068 0.461 . . . . 3.6800000000000002 110.547 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.542 HE21 ' N ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER -144.99 -148.7 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.599 -0.728 . . . . 4.3099999999999996 109.662 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.8 66.86 1.36 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.885 0.374 . . . . 3.8500000000000001 110.758 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.32 -98.73 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.066 -0.515 . . . . 1.9199999999999999 110.91 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.501 ' N ' HD22 ' A' ' 53' ' ' ASN . 88.8 p -178.66 140.82 0.19 Allowed 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.746 0.308 . . . . 2.2799999999999998 111.051 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -71.44 -18.54 62.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.094 0.473 . . . . 1.3 109.744 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 48.2 t -78.8 -10.94 59.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.66 -0.7 . . . . 1.5800000000000001 110.325 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.25 -46.18 23.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.582 . . . . 0.33000000000000002 110.341 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.545 ' HB ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -71.29 -25.71 25.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.20999999999999999 109.235 178.534 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.692 HD21 ' NE2' ' A' ' 105' ' ' GLN . 1.7 tm? -75.63 -48.5 21.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.879 -1.055 . . . . 0.23999999999999999 110.425 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -61.35 -52.23 65.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.609 0.718 . . . . 2.3199999999999998 109.272 179.017 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.04 -26.84 67.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.588 -1.187 . . . . 0.28999999999999998 108.448 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.86 -49.21 69.59 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.06 -0.973 . . . . 0.40000000000000002 112.478 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.517 ' NZ ' HE22 ' A' ' 105' ' ' GLN . 1.0 OUTLIER -60.72 -43.72 97.52 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.864 0.364 . . . . 0.82999999999999996 110.399 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 73' ' ' PHE . 17.6 m-80 -58.39 -42.19 86.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.878 -0.601 . . . . 0.53000000000000003 110.777 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.66 HD21 HG23 ' A' ' 43' ' ' THR . 1.1 tm? -58.5 -48.66 80.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 1.4099999999999999 110.223 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.474 ' O ' ' HB ' ' A' ' 75' ' ' VAL . 47.8 t80 -60.62 -33.29 72.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.75 110.914 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.4 p -80.76 -16.77 52.96 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.207 0.447 . . . . 1.1299999999999999 112.207 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 69' ' ' ASN . 24.3 m-85 -80.28 -44.29 19.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.506 -0.924 . . . . 0.28000000000000003 108.506 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 78' ' ' VAL . 7.8 m -70.93 -27.4 63.74 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.337 -0.847 . . . . 0.90000000000000002 109.15 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 71' ' ' TYR . 0.4 OUTLIER -64.57 -38.32 82.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-N 115.618 -0.719 . . . . 0.42999999999999999 110.95 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.8 t -91.27 -11.71 37.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.922 0.392 . . . . 0.90000000000000002 110.44 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.472 ' HB2' HG22 ' A' ' 34' ' ' ILE . 1.2 t80 -90.7 -26.58 19.48 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.919 -0.582 . . . . 0.25 111.929 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.498 HG11 ' HG2' ' A' ' 91' ' ' ARG . 2.8 m -63.06 -10.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 121.125 0.488 . . . . 0.97999999999999998 111.044 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.0 6.67 3.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.958 -0.565 . . . . 1.3100000000000001 110.598 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 41.1 t -126.66 -1.17 6.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.039 -0.528 . . . . 1.49 111.106 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.527 HG21 ' HG3' ' A' ' 87' ' ' LYS . 18.3 mm -40.74 -30.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 112.444 0.535 . . . . 1.3899999999999999 112.444 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.537 ' NE2' ' C ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 61.57 -72.36 0.04 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 123.767 0.667 . . . . 2.5499999999999998 109.863 -178.175 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.696 HE22 ' HG2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -49.02 156.5 0.51 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.256 -1.016 . . . . 2.5600000000000001 108.256 179.371 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.4 ptm -122.48 -34.66 3.22 Favored 'General case' 0 C--N 1.314 -0.957 0 C-N-CA 120.019 -0.672 . . . . 2.71 112.723 -177.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.696 ' HG2' HE22 ' A' ' 83' ' ' GLN . 39.6 ptt180 -86.02 27.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.315 -0.624 . . . . 2.7799999999999998 109.315 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.695 ' ND2' ' HB3' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -132.11 -29.47 1.63 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.9 -1.046 . . . . 2.4900000000000002 110.77 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 91' ' ' ARG . 7.8 mttt -39.69 -50.19 2.3 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.731 -0.668 . . . . 2.2799999999999998 111.519 -178.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -56.39 -48.74 76.27 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.238 -0.437 . . . . 2.4900000000000002 110.455 -179.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 92' ' ' GLU . . . -49.09 -68.37 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.046 0.388 . . . . 0.34999999999999998 112.046 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.731 ' CE2' HD11 ' A' ' 94' ' ' ILE . 89.5 t80 -66.43 -50.23 64.09 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.429 0.899 . . . . 0.28000000000000003 113.429 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.625 ' HA ' HD12 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -58.55 -47.86 82.81 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.339 -0.144 . . . . 3.3399999999999999 111.308 -176.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 6.5 pt-20 -58.9 -37.88 77.61 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.651 -0.5 . . . . 2.5800000000000001 109.651 178.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.18 -41.28 88.11 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.172 -0.677 . . . . 0.28999999999999998 109.172 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.731 HD11 ' CE2' ' A' ' 90' ' ' PHE . 40.4 mt -60.19 -42.75 91.39 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.289 -0.869 . . . . 0.23999999999999999 109.039 178.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.624 ' ND2' ' HD2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -58.53 -44.79 89.69 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 114.556 -1.202 . . . . 0.33000000000000002 109.666 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.624 ' HD2' ' ND2' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -48.44 -45.82 36.92 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.093 0.473 . . . . 1.6399999999999999 109.783 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.802 ' CD1' HD21 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -60.63 -40.75 93.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.76 . . . . 0.62 110.055 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -55.29 -61.29 2.43 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.707 -0.679 . . . . 1.8700000000000001 111.627 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.442 ' ND2' ' O ' ' A' ' 95' ' ' ASN . 0.2 OUTLIER -60.42 -35.44 75.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.907 -0.405 . . . . 2.1200000000000001 109.907 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.71 ' ND2' HD23 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -58.93 -34.58 71.9 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.895 -0.779 . . . . 0.26000000000000001 108.895 177.434 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.802 HD21 ' CD1' ' A' ' 97' ' ' LEU . 10.9 mt -71.06 -41.65 70.45 Favored 'General case' 0 C--N 1.34 0.171 0 N-CA-C 108.307 -0.997 . . . . 0.57999999999999996 108.307 177.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 99' ' ' ASN . 90.8 mtt180 -54.21 -47.85 71.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.693 -1.14 . . . . 2.0899999999999999 111.478 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -79.01 -23.99 43.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.862 0.363 . . . . 2.3199999999999998 110.66 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.3 tp -73.66 -15.8 61.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.31 111.334 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.692 ' NE2' HD21 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -51.26 163.36 0.25 Allowed 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 116.386 -0.37 . . . . 2.04 110.912 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.549 HD13 ' O ' ' A' ' 107' ' ' CYS . 0.0 OUTLIER -58.27 -50.91 76.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.374 -0.376 . . . . 1.6899999999999999 111.022 -179.549 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' CYS . . . . . 0.549 ' O ' HD13 ' A' ' 106' ' ' ILE . 35.5 t 61.59 141.17 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.271 0 CA-C-N 116.395 -0.366 . . . . 2.4399999999999999 111.462 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.475 ' HD2' ' SG ' ' A' ' 107' ' ' CYS . 31.9 Cg_exo -58.7 -77.6 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.503 2.135 . . . . 3.0099999999999998 112.41 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.51 ' HA ' ' HB3' ' A' ' 113' ' ' SER . . . -176.2 20.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.415 -0.357 . . . . 4.4199999999999999 111.2 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 m -48.32 -50.94 28.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.955 -0.566 . . . . 5.4100000000000001 111.351 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.59 33.36 0.7 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 5.8300000000000001 111.168 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.06 88.9 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.831 -0.699 . . . . 5.1600000000000001 112.508 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.51 ' HB3' ' HA ' ' A' ' 109' ' ' ALA . 41.1 t -129.81 105.19 7.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 4.5499999999999998 111.19 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -156.8 -83.34 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.814 -0.708 . . . . 4.4199999999999999 112.268 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.0 161.64 43.0 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.3 2.0 . . . . 5.5700000000000003 111.954 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . 57.99 -169.91 0.11 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.305 -0.407 . . . . 3.79 111.203 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -123.71 -55.26 1.72 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.264 -0.425 . . . . 2.6800000000000002 110.849 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.4 p 43.65 87.05 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.351 0.596 . . . . 2.4199999999999999 110.794 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.421 HE21 ' HB2' ' A' ' 119' ' ' GLN . 0.0 OUTLIER -145.65 84.8 1.68 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.217 -0.901 . . . . 2.3500000000000001 112.489 -178.155 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -114.2 86.8 2.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 2.1600000000000001 109.376 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.427 ' CD1' ' N ' ' A' ' 121' ' ' PHE . 1.6 m-30 -83.05 43.72 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.46999999999999997 112.021 -178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 89.7 p -67.93 -15.93 63.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 1.26 110.085 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -69.97 -36.65 75.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.13 -0.693 . . . . 2.5800000000000001 109.13 178.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.573 HD13 ' ND2' ' A' ' 100' ' ' ASN . 0.3 OUTLIER -65.6 -23.81 66.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.441 -0.948 . . . . 0.26000000000000001 108.441 178.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.37 -48.62 32.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.877 -1.056 . . . . 1.3 110.309 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.2 t -66.59 -34.78 78.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.84 -0.618 . . . . 1.3999999999999999 110.86 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 131' ' ' ILE . 67.5 m -62.44 -45.7 91.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.941 -0.572 . . . . 1.0900000000000001 111.157 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 124' ' ' LEU . 46.1 t -60.52 -54.86 29.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.51000000000000001 111.51 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -50.51 -38.94 47.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.96 -0.563 . . . . 2.6899999999999999 111.39 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.09 -56.02 23.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.971 -0.558 . . . . 2.1000000000000001 112.46 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.703 HG22 ' CE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -52.36 -55.31 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.681 0.277 . . . . 0.28999999999999998 111.13 -178.743 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.467 ' HB2' HE21 ' A' ' 136' ' ' GLN . 54.4 p -53.73 -47.42 70.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 1.02 111.004 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -53.01 -29.58 30.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.38 -0.373 . . . . 0.37 111.752 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.485 ' HA ' ' NH2' ' A' ' 137' ' ' ARG . 65.9 mt -79.3 -51.42 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.837 0.68 . . . . 0.26000000000000001 112.837 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.666 HG21 ' HG3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -57.57 -45.55 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.518 0.562 . . . . 0.25 112.518 -178.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . 0.467 HE21 ' HB2' ' A' ' 132' ' ' SER . 45.4 mt-30 -49.29 -49.19 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.465 -0.334 . . . . 0.91000000000000003 111.737 -178.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.485 ' NH2' ' HA ' ' A' ' 134' ' ' ILE . 0.0 OUTLIER -78.28 -15.18 59.01 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.615 -0.513 . . . . 4.0599999999999996 109.615 178.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 135' ' ' VAL . 0.5 OUTLIER -81.38 -79.19 0.17 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.47 -0.786 . . . . 1.8899999999999999 110.622 179.636 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.416 ' N ' HD13 ' A' ' 138' ' ' LEU . 43.3 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.245 -0.883 . . . . 4.1699999999999999 110.956 179.717 . . . . . . . . 1 1 . 1 stop_ save_