data_2kuh_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 2kuh _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 ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 . . . . . 0 CA--C 1.492 -1.271 0 N-CA-C 108.237 -1.023 . . . . 20.0 108.237 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -65.73 -33.59 76.24 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 125.909 2.006 . . . . 2.2200000000000002 113.957 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 48.8 mm-40 -52.75 -55.82 20.05 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-O 125.955 2.788 . . . . 2.2799999999999998 112.068 -178.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 pt -73.92 -48.73 37.65 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 CA-C-N 111.272 -2.695 . . . . 0.29999999999999999 114.461 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.435 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -76.46 -55.57 5.42 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 117.764 -1.574 . . . . 3.2799999999999998 113.894 -174.731 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -63.91 -41.1 97.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.149 -1.387 . . . . 3.0499999999999998 112.862 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.42 -37.97 87.89 Favored 'General case' 0 C--O 1.213 -0.866 0 C-N-CA 113.009 -3.477 . . . . 0.070000000000000007 110.04 172.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.577 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.7 t80 -54.71 -30.32 55.63 Favored 'General case' 0 C--N 1.349 0.567 0 N-CA-C 116.053 1.871 . . . . 0.11 116.053 167.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -67.88 -39.69 83.64 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 117.585 -1.646 . . . . 5.8399999999999999 111.894 174.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 27.4 t -67.71 -29.88 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 118.192 -1.403 . . . . 0.11 112.926 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.577 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -63.03 -50.92 68.78 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 113.372 -1.74 . . . . 0.20999999999999999 110.358 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -80.58 79.09 7.25 Favored 'General case' 0 CA--C 1.51 -0.564 0 O-C-N 126.303 2.252 . . . . 1.46 110.716 168.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -55.71 -33.69 64.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 111.12 -2.764 . . . . 4.7599999999999998 114.317 -174.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.427 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 22.8 p-10 -90.11 -17.89 26.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 112.781 -2.008 . . . . 3.1000000000000001 113.231 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.97 23.46 77.02 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 117.701 -2.19 . . . . 0.46000000000000002 111.939 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.447 HD21 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.92 -9.74 17.12 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 115.469 1.655 . . . . 1.5700000000000001 115.469 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.447 ' N ' HD21 ' A' ' 97' ' ' ASN . . . 87.19 -26.69 6.68 Favored Glycine 0 C--N 1.348 1.239 0 N-CA-C 116.413 1.325 . . . . 0.23999999999999999 116.413 -171.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.427 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 41.9 m-85 -110.56 145.19 38.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 123.351 1.548 . . . . 20.0 111.845 -176.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.436 HD12 ' CE1' ' A' ' 89' ' ' PHE . 27.6 mm -105.43 131.53 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 112.482 -2.145 . . . . 0.31 110.068 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -101.75 162.21 13.07 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 113.982 -3.087 . . . . 0.91000000000000003 109.762 170.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.513 ' HB2' HG13 ' A' ' 121' ' ' VAL . . . -49.26 -42.91 42.3 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 127.453 3.502 . . . . 0.11 112.246 173.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.97 -37.22 68.75 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 111.891 -2.413 . . . . 0.12 114.641 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.454 ' O ' HG12 ' A' ' 108' ' ' VAL . 2.5 tt0 -74.74 -29.26 61.1 Favored 'General case' 0 CA--C 1.495 -1.173 0 CA-C-N 113.638 -1.619 . . . . 0.81000000000000005 114.146 174.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.514 HD22 ' HE2' ' A' ' 144' ' ' MET . 0.2 OUTLIER -53.88 -52.62 59.88 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 117.283 -1.767 . . . . 0.16 109.398 170.559 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.439 ' HE ' HG22 ' A' ' 121' ' ' VAL . 22.7 ttp85 -52.91 -32.64 46.42 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 115.255 1.576 . . . . 4.3499999999999996 115.255 173.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -59.29 -54.15 50.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 116.769 -1.973 . . . . 0.70999999999999996 112.805 170.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.54 ' O ' HD23 ' A' ' 112' ' ' LEU . 0.9 OUTLIER -55.45 -35.3 37.04 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 125.33 1.644 . . . . 0.10000000000000001 111.54 176.549 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.516 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 35.8 mmm -64.01 -41.71 97.37 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 123.461 1.601 . . . . 0.12 113.161 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.3 m -57.1 -43.34 82.15 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 113.617 -1.629 . . . . 0.59999999999999998 112.872 171.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -60.72 -38.85 86.45 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 123.821 1.772 . . . . 1.25 113.207 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.54 HD23 ' O ' ' A' ' 108' ' ' VAL . 3.2 mm? -68.46 -8.24 39.09 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 112.402 -2.181 . . . . 0.45000000000000001 112.254 179.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.43 -40.24 2.53 Favored Glycine 0 C--N 1.342 0.906 0 C-N-CA 118.229 -1.939 . . . . 0.40999999999999998 110.854 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.516 ' O ' ' HB3' ' A' ' 109' ' ' MET . 20.0 mm-40 -97.6 117.71 32.49 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-N 112.451 -1.874 . . . . 2.29 111.524 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -109.96 116.03 30.87 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 117.62 -1.632 . . . . 2.2599999999999998 110.657 -176.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.431 HD12 ' HE3' ' A' ' 124' ' ' MET . 2.6 mp -95.84 152.51 18.43 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 116.098 -2.241 . . . . 3.77 109.187 -178.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 121' ' ' VAL . 81.2 p -74.76 175.91 7.52 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 117.764 -1.574 . . . . 0.51000000000000001 112.641 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.448 ' O ' ' HB ' ' A' ' 121' ' ' VAL . 56.0 m-20 -50.82 -37.8 45.02 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.017 1.488 . . . . 1.6000000000000001 115.017 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -54.62 -48.7 71.91 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-O 124.536 2.112 . . . . 1.75 112.54 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.418 ' O ' ' SD ' ' A' ' 124' ' ' MET . 6.4 mm-40 -70.16 -39.05 75.54 Favored 'General case' 0 C--O 1.206 -1.21 0 CA-C-N 110.629 -2.987 . . . . 0.68000000000000005 111.073 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.602 ' O ' ' HB2' ' A' ' 124' ' ' MET . 80.1 t -51.82 -35.24 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 124.13 1.919 . . . . 0.44 114.556 173.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.84 -44.37 90.01 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.073 -2.251 . . . . 1.29 112.818 169.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -56.92 -28.07 61.6 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 118.475 -1.29 . . . . 3.1899999999999999 114.149 168.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.602 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -62.63 -42.36 99.55 Favored 'General case' 0 CA--C 1.484 -1.588 0 CA-C-O 117.34 -1.314 . . . . 1.8100000000000001 111.023 172.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.462 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 17.1 mt -53.92 -46.23 64.27 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.583 0 C-N-CA 116.879 -1.929 . . . . 0.11 110.217 170.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -57.39 13.24 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 115.496 -2.482 . . . . 5.3399999999999999 116.032 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -65.31 -27.5 68.65 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 124.835 2.255 . . . . 1.95 113.602 -176.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.55 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -90.45 -25.99 20.06 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 112.399 -2.182 . . . . 0.11 114.402 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -89.59 90.83 8.43 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 126.814 2.571 . . . . 1.9299999999999999 111.333 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.6 mp -94.66 -33.74 5.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 122.645 1.212 . . . . 0.45000000000000001 113.293 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.0 p30 -66.36 -32.6 74.09 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 113.243 -1.798 . . . . 1.1499999999999999 113.012 174.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.56 65.06 2.14 Favored Glycine 0 C--N 1.345 1.038 0 C-N-CA 116.868 -2.587 . . . . 1.1499999999999999 113.677 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -119.94 -11.02 9.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 113.253 -1.473 . . . . 2.4900000000000002 113.68 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.38 19.78 51.14 Favored Glycine 0 C--N 1.354 1.534 0 N-CA-C 116.549 1.38 . . . . 0.39000000000000001 116.549 -174.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -154.13 162.9 40.88 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.007 1.723 . . . . 2.5499999999999998 107.81 -173.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.436 HG12 ' HB2' ' A' ' 128' ' ' ALA . 97.3 t -113.96 119.85 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.676 0 C-N-CA 115.251 -2.579 . . . . 0.34999999999999998 107.218 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -106.71 179.97 4.11 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 114.111 -3.036 . . . . 3.0299999999999998 114.293 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -68.41 -33.86 74.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 124.185 1.945 . . . . 20.0 114.353 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -61.66 -47.63 84.5 Favored 'General case' 0 CA--C 1.492 -1.282 0 CA-C-N 110.634 -2.985 . . . . 2.8999999999999999 110.162 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.55 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 80.8 mt-10 -63.38 -30.78 71.85 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-N 111.308 -2.678 . . . . 2.77 114.178 172.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -56.62 -39.21 73.22 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 124.285 1.993 . . . . 0.38 112.458 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.38 -47.63 76.73 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 CA-C-N 111.995 -2.366 . . . . 0.40000000000000002 111.908 170.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -60.9 -26.61 67.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.903 1.446 . . . . 2.25 114.903 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.514 ' HE2' HD22 ' A' ' 105' ' ' LEU . 4.7 ttm -74.42 -53.46 9.52 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 124.958 2.314 . . . . 0.79000000000000004 110.587 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 28.1 mtt -76.66 -50.84 12.74 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 115.823 -2.351 . . . . 0.35999999999999999 114.143 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.0 m -60.78 -56.53 20.16 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 112.937 -1.938 . . . . 0.81999999999999995 112.37 176.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.25 -167.21 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 O-C-N 124.842 1.339 . . . . 1.28 112.101 -177.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 10.2 tptt . . . . . 0 C--N 1.346 0.431 0 CA-C-O 118.175 -0.917 . . . . 20.0 112.12 -179.41 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 CA--C 1.496 -1.102 0 CA-C-O 117.785 -1.102 . . . . 20.0 108.132 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.59 -33.03 74.97 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 125.743 1.902 . . . . 2.2200000000000002 114.118 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.2 mm-40 -53.59 -56.9 13.19 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 126.24 2.924 . . . . 2.2799999999999998 112.182 -178.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.7 pt -72.16 -50.33 37.34 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 CA-C-N 111.256 -2.702 . . . . 0.29999999999999999 114.207 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.41 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -73.55 -56.67 4.72 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.053 -1.43 . . . . 3.2799999999999998 113.897 -174.302 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.02 -37.29 81.22 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 113.846 -1.525 . . . . 3.0499999999999998 113.851 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.67 -38.32 89.86 Favored 'General case' 0 C--O 1.213 -0.831 0 C-N-CA 113.277 -3.369 . . . . 0.070000000000000007 109.702 169.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.587 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.8 t80 -56.91 -29.76 63.33 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 115.643 1.72 . . . . 0.11 115.643 168.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -67.81 -39.49 83.95 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 117.344 -1.742 . . . . 5.8399999999999999 112.035 176.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.75 -32.82 58.32 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 114.057 -1.429 . . . . 0.11 111.991 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.589 ' HB3' HG13 ' A' ' 108' ' ' VAL . 18.7 m-30 -60.52 -49.25 78.32 Favored 'General case' 0 CA--C 1.497 -1.078 0 O-C-N 125.745 1.903 . . . . 0.20999999999999999 111.635 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -78.99 80.28 5.34 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.325 2.012 . . . . 1.46 109.681 169.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -56.82 -30.56 63.87 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 111.409 -2.632 . . . . 4.7599999999999998 113.568 -171.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.405 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 13.5 p30 -90.43 -18.33 25.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 113.095 -1.866 . . . . 3.1000000000000001 113.896 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.17 15.89 76.81 Favored Glycine 0 C--N 1.343 0.927 0 C-N-CA 116.802 -2.618 . . . . 0.46000000000000002 113.103 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.451 HD21 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -64.92 -10.5 29.37 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.011 1.856 . . . . 1.5700000000000001 116.011 -177.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.451 ' N ' HD21 ' A' ' 97' ' ' ASN . . . 90.59 -29.07 7.0 Favored Glycine 0 C--N 1.347 1.178 0 N-CA-C 116.113 1.205 . . . . 0.23999999999999999 116.113 -172.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -110.07 146.35 35.54 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 113.581 -1.309 . . . . 20.0 111.696 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.458 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 37.9 mm -109.26 130.47 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 CA-C-N 112.641 -2.072 . . . . 0.31 110.881 -179.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 t -101.43 163.21 12.39 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 114.486 -2.885 . . . . 0.91000000000000003 108.955 171.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.466 ' HB2' HG13 ' A' ' 121' ' ' VAL . . . -50.43 -42.5 54.08 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 127.825 3.678 . . . . 0.11 112.11 176.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -53.58 -37.7 63.21 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.604 -2.544 . . . . 0.12 114.778 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.533 ' O ' HG12 ' A' ' 108' ' ' VAL . 1.7 mt-10 -74.69 -30.52 61.59 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 115.512 1.671 . . . . 0.81000000000000005 115.512 172.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.638 HD13 ' HG3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -55.65 -35.85 66.4 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 115.825 -2.35 . . . . 0.16 111.673 170.433 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.401 ' NH1' ' OD1' ' A' ' 118' ' ' ASP . 64.4 ttt180 -67.83 -30.47 69.88 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 113.957 -1.474 . . . . 4.3499999999999996 113.913 172.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.4 t60 -62.32 -50.3 72.18 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 116.979 -1.888 . . . . 0.70999999999999996 111.142 171.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.589 HG13 ' HB3' ' A' ' 92' ' ' PHE . 0.9 OUTLIER -55.42 -40.59 58.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 CA-C-N 113.623 -1.626 . . . . 0.10000000000000001 110.687 177.756 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.511 ' SD ' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -60.41 -39.71 88.37 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 125.633 2.635 . . . . 0.12 113.466 174.423 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 19.9 m -53.83 -47.99 70.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 112.871 -1.968 . . . . 0.59999999999999998 113.413 171.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -61.91 -37.23 83.86 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 126.559 2.412 . . . . 1.25 112.96 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.9 mm? -63.55 -11.59 25.68 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 113.874 -1.512 . . . . 0.45000000000000001 111.781 176.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.05 -34.83 4.94 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 118.637 -1.744 . . . . 0.40999999999999998 110.36 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 109' ' ' MET . 23.7 mt-10 -108.23 108.45 19.49 Favored 'General case' 0 C--O 1.215 -0.741 0 CA-C-N 112.888 -1.656 . . . . 2.29 109.093 -173.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -89.34 135.52 33.54 Favored 'General case' 0 CA--C 1.498 -1.026 0 C-N-CA 116.44 -2.104 . . . . 2.2599999999999998 110.895 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.511 HD23 ' SD ' ' A' ' 109' ' ' MET . 1.3 mm? -101.4 155.67 17.92 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 126.534 2.396 . . . . 3.77 109.582 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.534 ' O ' HG23 ' A' ' 121' ' ' VAL . 74.0 p -78.14 170.25 16.92 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 116.592 -2.043 . . . . 0.51000000000000001 112.044 -173.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.401 ' OD1' ' NH1' ' A' ' 106' ' ' ARG . 50.1 m-20 -55.04 -31.72 61.31 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 114.662 1.356 . . . . 1.6000000000000001 114.662 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.42 -48.42 81.72 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 125.268 2.461 . . . . 1.75 112.018 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.486 ' O ' ' SD ' ' A' ' 124' ' ' MET . 48.5 mm-40 -67.01 -39.06 86.98 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 109.543 -3.48 . . . . 0.68000000000000005 111.472 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.648 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.1 t -53.34 -33.87 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 124.371 2.034 . . . . 0.44 114.021 174.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -68.54 -41.81 79.31 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 115.938 -2.305 . . . . 1.29 112.921 170.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -56.96 -26.76 60.39 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 118.092 -1.443 . . . . 3.1899999999999999 114.385 167.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.648 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -64.21 -40.51 96.2 Favored 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 115.371 -0.831 . . . . 1.8100000000000001 111.003 173.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 22.0 mt -53.51 -48.5 58.14 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.439 0 C-N-CA 116.036 -2.266 . . . . 0.11 110.08 168.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -54.53 45.66 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 116.668 2.099 . . . . 5.3399999999999999 116.668 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.4 -28.06 68.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 123.478 1.609 . . . . 1.95 112.611 -176.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.51 ' HB2' HG12 ' A' ' 136' ' ' VAL . . . -92.28 -25.4 18.61 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 113.161 -1.836 . . . . 0.11 115.047 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -89.4 92.44 9.14 Favored 'General case' 0 C--N 1.338 0.085 0 O-C-N 126.729 2.518 . . . . 1.9299999999999999 111.181 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.22 -32.26 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 123.125 1.441 . . . . 0.45000000000000001 113.354 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -69.08 -30.96 69.39 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 112.832 -1.985 . . . . 1.1499999999999999 113.632 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.14 63.46 2.66 Favored Glycine 0 C--N 1.345 1.065 0 C-N-CA 117.389 -2.339 . . . . 1.1499999999999999 114.173 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -118.54 -12.17 9.82 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 113.294 -1.453 . . . . 2.4900000000000002 113.586 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.17 22.3 38.61 Favored Glycine 0 C--N 1.35 1.347 0 N-CA-C 116.635 1.414 . . . . 0.39000000000000001 116.635 -175.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -155.98 163.93 39.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.775 1.63 . . . . 2.5499999999999998 108.267 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.51 HG12 ' HB2' ' A' ' 128' ' ' ALA . 90.2 t -115.26 119.36 61.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 116.316 -2.153 . . . . 0.34999999999999998 108.277 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -105.29 173.76 6.17 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 115.959 -2.297 . . . . 3.0299999999999998 114.142 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -64.77 -36.56 84.71 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 124.274 1.988 . . . . 20.0 114.276 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.96 -45.5 94.48 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 111.351 -2.659 . . . . 2.8999999999999999 110.51 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.507 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 64.4 mt-10 -64.63 -31.63 72.94 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-N 110.5 -3.046 . . . . 2.77 114.445 172.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.479 ' CE1' ' HE3' ' A' ' 145' ' ' MET . 9.1 t80 -56.88 -40.7 76.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.953 1.835 . . . . 0.38 111.445 173.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.449 HG12 ' HG1' ' A' ' 146' ' ' THR . 78.4 t -65.87 -46.45 88.54 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 CA-C-N 112.802 -1.999 . . . . 0.40000000000000002 112.326 170.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -57.71 -33.97 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 114.333 1.234 . . . . 2.25 114.333 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.815 ' HE3' ' HE1' ' A' ' 145' ' ' MET . 14.9 ttp -76.95 -48.04 19.22 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 123.796 1.76 . . . . 0.79000000000000004 111.673 -178.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.815 ' HE1' ' HE3' ' A' ' 144' ' ' MET . 17.5 mmt -72.15 -56.86 4.86 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.53 -2.068 . . . . 0.35999999999999999 112.452 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' THR . . . . . 0.449 ' HG1' HG12 ' A' ' 142' ' ' VAL . 17.4 m -60.31 -56.33 22.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 111.849 -2.432 . . . . 0.81999999999999995 112.885 178.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 57.03 -163.63 0.17 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.396 -1.274 . . . . 1.28 112.031 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.344 0.333 0 CA-C-N 115.19 -0.914 . . . . 20.0 111.625 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 107.861 -1.162 . . . . 20.0 107.861 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.44 ' HB2' ' HB3' ' A' ' 87' ' ' GLU . 2.1 pp20? -67.32 -33.44 75.26 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 126.223 2.202 . . . . 2.2200000000000002 112.905 174.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.1 mm-40 -53.76 -54.18 41.76 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 125.231 2.443 . . . . 2.2799999999999998 112.864 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.6 pt -73.38 -49.41 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 114.67 -2.812 . . . . 0.29999999999999999 114.489 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -53.06 8.31 Favored 'General case' 0 C--O 1.206 -1.187 0 C-N-CA 118.327 -1.349 . . . . 3.2799999999999998 113.892 -174.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.44 ' HB3' ' HB2' ' A' ' 83' ' ' GLU . 16.6 tt0 -70.35 -35.53 73.63 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 114.654 1.353 . . . . 3.0499999999999998 114.654 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -63.0 -39.22 94.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 113.434 -3.307 . . . . 0.070000000000000007 109.981 166.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.581 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 84.8 t80 -56.17 -30.41 62.19 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.25 1.574 . . . . 0.11 115.25 169.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -37.64 77.92 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 115.683 -2.407 . . . . 5.8399999999999999 110.553 176.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.1 t -65.1 -34.55 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 116.624 -2.03 . . . . 0.11 113.238 173.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.581 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.1 m-30 -61.23 -48.54 80.98 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 112.103 -2.317 . . . . 0.20999999999999999 111.228 -178.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -76.42 76.61 3.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 125.034 2.35 . . . . 1.46 111.368 166.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -60.05 -30.09 68.97 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 111.213 -2.721 . . . . 4.7599999999999998 115.314 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -85.4 -26.21 26.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 112.393 -2.185 . . . . 3.1000000000000001 112.418 175.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.76 27.08 73.69 Favored Glycine 0 C--N 1.344 1.001 0 CA-C-N 113.223 -1.808 . . . . 0.46000000000000002 111.685 178.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -68.19 -16.79 64.13 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 125.307 1.24 . . . . 1.5700000000000001 114.188 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.67 -14.7 64.46 Favored Glycine 0 C--N 1.343 0.962 0 O-C-N 125.422 1.701 . . . . 0.23999999999999999 113.743 -175.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -114.38 146.76 40.15 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.295 -1.453 . . . . 20.0 109.651 -173.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.9 mm -113.27 135.0 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.768 0 CA-C-N 112.669 -2.06 . . . . 0.31 110.078 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.0 t -107.4 159.72 16.18 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 116.242 -2.183 . . . . 0.91000000000000003 108.511 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HB2' HG13 ' A' ' 121' ' ' VAL . . . -46.19 -43.45 15.24 Favored 'General case' 0 CA--C 1.548 0.883 1 CA-C-O 128.513 4.006 . . . . 0.11 113.226 177.681 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -54.62 -46.83 73.95 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 110.717 -2.947 . . . . 0.12 115.201 174.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -28.15 69.73 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 115.356 1.613 . . . . 0.81000000000000005 115.356 172.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.557 ' HG ' ' HB3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -54.64 -50.65 67.62 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 117.185 -1.806 . . . . 0.16 111.0 167.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -54.76 -28.52 49.21 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 117.358 -1.737 . . . . 4.3499999999999996 115.256 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -62.86 -54.99 30.22 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 116.871 -1.932 . . . . 0.70999999999999996 111.806 171.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.551 ' O ' HD23 ' A' ' 112' ' ' LEU . 2.7 m -57.68 -33.42 45.0 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 116.728 -1.989 . . . . 0.10000000000000001 111.171 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.585 ' HE1' HD23 ' A' ' 116' ' ' LEU . 41.7 mmm -60.58 -44.52 96.11 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 123.292 1.52 . . . . 0.12 113.547 171.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.4 m -55.51 -45.18 77.14 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 113.62 -1.627 . . . . 0.59999999999999998 112.384 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -59.24 -41.86 89.71 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 123.615 1.674 . . . . 1.25 112.826 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.551 HD23 ' O ' ' A' ' 108' ' ' VAL . 1.6 mm? -64.44 -7.5 10.15 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 112.688 -2.051 . . . . 0.45000000000000001 112.363 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.8 -35.99 4.06 Favored Glycine 0 C--N 1.339 0.705 0 C-N-CA 117.835 -2.126 . . . . 0.40999999999999998 110.796 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 109' ' ' MET . 33.2 mm-40 -108.5 111.07 22.75 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.574 -1.813 . . . . 2.29 110.645 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -93.32 130.12 39.18 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 113.932 -1.485 . . . . 2.2599999999999998 111.056 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.585 HD23 ' HE1' ' A' ' 109' ' ' MET . 4.4 mm? -95.02 153.16 17.77 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 116.375 -2.13 . . . . 3.77 109.82 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.536 ' O ' HG23 ' A' ' 121' ' ' VAL . 44.6 p -76.21 169.57 17.96 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 113.725 -1.579 . . . . 0.51000000000000001 112.333 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -52.48 -33.92 46.83 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.702 1.371 . . . . 1.6000000000000001 114.702 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -52.31 65.99 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 126.751 3.167 . . . . 1.75 111.125 176.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 124' ' ' MET . 12.2 mm-40 -61.73 -35.71 78.86 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 109.286 -3.597 . . . . 0.68000000000000005 112.526 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.623 HG13 ' HB2' ' A' ' 102' ' ' ALA . 88.3 t -55.12 -36.33 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 123.5 1.619 . . . . 0.44 114.15 176.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.08 -44.9 78.88 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 112.415 -2.175 . . . . 1.29 111.628 172.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -57.4 -28.74 63.5 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 118.146 -1.421 . . . . 3.1899999999999999 114.281 168.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.557 ' HB3' ' HG ' ' A' ' 105' ' ' LEU . 25.9 mmt -65.96 -37.03 84.94 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 115.253 -0.885 . . . . 1.8100000000000001 110.709 178.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 14.3 mt -56.82 -50.23 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 116.151 -2.22 . . . . 0.11 109.736 168.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -37.73 73.79 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 116.029 1.863 . . . . 5.3399999999999999 116.029 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -78.72 -32.1 46.71 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-O 124.709 2.195 . . . . 1.95 112.226 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.491 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -89.08 -26.6 21.29 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 112.705 -2.043 . . . . 0.11 114.092 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -86.53 91.27 8.5 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 126.612 2.445 . . . . 1.9299999999999999 111.45 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.0 mp -95.5 -32.94 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-N 114.019 -1.446 . . . . 0.45000000000000001 112.791 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -67.83 -33.44 74.78 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 113.253 -1.794 . . . . 1.1499999999999999 113.73 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.09 64.57 2.28 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 118.179 -1.962 . . . . 1.1499999999999999 113.419 -176.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -119.48 -10.95 9.56 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 113.705 -1.248 . . . . 2.4900000000000002 113.595 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.39 22.72 39.57 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 116.616 1.406 . . . . 0.39000000000000001 116.616 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -156.3 164.87 37.8 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.084 1.354 . . . . 2.5499999999999998 107.668 -174.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.472 HG12 ' HB2' ' A' ' 128' ' ' ALA . 94.3 t -115.54 119.54 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 115.84 -2.344 . . . . 0.34999999999999998 107.133 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -104.78 175.14 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 116.001 -2.28 . . . . 3.0299999999999998 114.969 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.401 ' HD2' ' OE2' ' A' ' 139' ' ' GLU . 40.8 t80 -64.68 -35.2 80.27 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 123.279 1.514 . . . . 20.0 113.899 177.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.401 ' OE2' ' HD2' ' A' ' 138' ' ' TYR . 10.4 mm-40 -62.94 -46.75 86.28 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 111.962 -2.381 . . . . 2.8999999999999999 110.466 -178.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.491 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 60.8 mt-10 -60.44 -31.07 70.07 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 110.394 -3.094 . . . . 2.77 114.854 171.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.96 -41.16 74.3 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 124.204 1.955 . . . . 0.38 112.195 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.7 t -69.13 -49.69 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 112.239 -2.255 . . . . 0.40000000000000002 112.109 171.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -56.06 -27.35 53.04 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 114.205 -1.362 . . . . 2.25 114.671 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.459 ' HE3' ' HB3' ' A' ' 144' ' ' MET . 0.9 OUTLIER -75.87 -53.3 8.66 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 124.155 1.931 . . . . 0.79000000000000004 110.899 178.608 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 33.0 mtt -76.47 -54.29 6.93 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 114.614 -2.834 . . . . 0.35999999999999999 114.731 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 23.3 m -57.08 -59.74 4.63 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.345 -1.752 . . . . 0.81999999999999995 112.686 173.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 52.66 -159.09 0.13 Allowed 'General case' 0 C--N 1.345 0.376 0 O-C-N 124.884 1.365 . . . . 1.28 111.47 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt . . . . . 0 C--N 1.347 0.49 0 CA-C-O 118.462 -0.78 . . . . 20.0 111.052 175.074 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 . . . . . 0 CA--C 1.502 -0.897 0 N-CA-C 106.95 -1.5 . . . . 20.0 106.95 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 0.0 OUTLIER -51.52 -37.13 47.88 Favored 'General case' 0 C--O 1.218 -0.571 0 O-C-N 125.895 1.997 . . . . 2.2200000000000002 114.013 168.75 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -50.63 -59.74 3.75 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 123.943 1.83 . . . . 2.2799999999999998 111.778 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.9 pt -73.02 -49.25 40.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 116.242 -2.183 . . . . 0.29999999999999999 115.481 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.43 -55.05 7.66 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 113.269 -1.787 . . . . 3.2799999999999998 113.948 -175.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -70.12 -35.27 73.99 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 117.9 -1.52 . . . . 3.0499999999999998 113.807 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.69 92.9 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 113.974 -3.091 . . . . 0.070000000000000007 109.305 170.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.544 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 76.4 t80 -56.45 -32.09 64.6 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 114.998 1.481 . . . . 0.11 114.998 168.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -65.96 -36.88 84.54 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 115.6 -2.44 . . . . 5.8399999999999999 113.521 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.1 t -70.26 -28.41 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 117.809 -1.556 . . . . 0.11 113.058 171.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.544 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.8 m-30 -63.03 -49.98 72.5 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 113.067 -1.879 . . . . 0.20999999999999999 111.571 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -76.5 79.32 3.2 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 126.959 2.662 . . . . 1.46 109.796 167.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -58.19 -30.46 66.47 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 111.435 -2.621 . . . . 4.7599999999999998 113.879 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.418 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 21.3 p-10 -91.48 -17.39 25.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 113.525 -1.671 . . . . 3.1000000000000001 113.756 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.66 20.47 79.63 Favored Glycine 0 C--N 1.343 0.931 0 C-N-CA 117.486 -2.292 . . . . 0.46000000000000002 112.828 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.426 HD21 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.66 -9.22 12.78 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 116.321 1.971 . . . . 1.5700000000000001 116.321 -178.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.426 ' N ' HD21 ' A' ' 97' ' ' ASN . . . 91.18 -31.3 5.75 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 124.821 1.326 . . . . 0.23999999999999999 115.056 -171.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.425 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 41.3 m-85 -110.81 145.87 37.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 112.806 -1.697 . . . . 20.0 112.651 -172.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' A' ' 104' ' ' GLU . 13.6 mm -102.88 133.84 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-N 112.146 -2.297 . . . . 0.31 110.01 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.9 t -107.23 159.12 16.59 Favored 'General case' 0 CA--C 1.503 -0.832 0 C-N-CA 115.197 -2.601 . . . . 0.91000000000000003 108.017 170.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.444 ' HB2' HG13 ' A' ' 121' ' ' VAL . . . -47.53 -42.47 23.39 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 127.927 3.727 . . . . 0.11 112.141 178.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.07 87.42 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-N 111.593 -2.549 . . . . 0.12 115.174 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.579 ' OE1' HD13 ' A' ' 100' ' ' ILE . 4.4 tt0 -66.26 -25.46 66.89 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 114.986 1.476 . . . . 0.81000000000000005 114.986 171.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.653 HD12 HG21 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -56.33 -45.83 80.16 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 116.293 -2.163 . . . . 0.16 111.306 167.298 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 -55.8 -28.22 55.11 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.176 1.941 . . . . 4.3499999999999996 115.327 171.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 55.7 t60 -65.1 -52.2 56.86 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 116.313 -2.155 . . . . 0.70999999999999996 112.008 170.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.653 HG21 HD12 ' A' ' 105' ' ' LEU . 1.2 m -55.65 -36.68 43.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.834 0 C-N-CA 116.233 -2.187 . . . . 0.10000000000000001 111.612 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.514 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 50.0 mmm -60.24 -44.54 95.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 125.211 2.434 . . . . 0.12 113.581 173.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 80.8 m -51.1 -47.01 62.02 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 112.815 -1.993 . . . . 0.59999999999999998 113.053 170.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.41 -39.24 90.05 Favored 'General case' 0 C--O 1.216 -0.661 0 O-C-N 125.837 1.96 . . . . 1.25 113.443 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.6 mm? -67.08 -7.96 26.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 123.38 1.562 . . . . 0.45000000000000001 112.274 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 97.78 -37.92 3.29 Favored Glycine 0 C--N 1.342 0.865 0 C-N-CA 118.514 -1.803 . . . . 0.40999999999999998 110.8 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.514 ' O ' ' HB3' ' A' ' 109' ' ' MET . 74.4 mm-40 -105.79 116.12 31.4 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-N 112.196 -2.002 . . . . 2.29 109.363 -173.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -94.41 128.91 41.25 Favored 'General case' 0 CA--C 1.502 -0.89 0 C-N-CA 115.718 -2.393 . . . . 2.2599999999999998 111.239 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.563 ' HB2' ' HE2' ' A' ' 124' ' ' MET . 39.3 mt -93.2 157.89 16.04 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 116.193 -2.203 . . . . 3.77 109.949 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.6 p -81.02 175.09 10.99 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 117.312 -1.755 . . . . 0.51000000000000001 111.406 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -58.44 -29.97 66.55 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 114.725 1.38 . . . . 1.6000000000000001 114.725 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.72 -50.98 71.73 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-O 124.991 2.329 . . . . 1.75 111.095 175.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.48 ' O ' ' SD ' ' A' ' 124' ' ' MET . 17.6 mm-40 -63.51 -43.23 97.82 Favored 'General case' 0 C--O 1.207 -1.174 0 CA-C-N 109.716 -3.402 . . . . 0.68000000000000005 110.693 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.605 ' O ' ' HB2' ' A' ' 124' ' ' MET . 72.6 t -51.51 -34.7 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 124.468 2.08 . . . . 0.44 115.022 174.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -65.35 -45.6 83.54 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 116.402 -2.119 . . . . 1.29 112.021 170.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -56.06 -29.09 60.0 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.262 -1.375 . . . . 3.1899999999999999 114.008 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.605 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -63.07 -39.35 94.45 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 112.06 0.393 . . . . 1.8100000000000001 112.06 174.399 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 24.2 mt -53.91 -48.95 62.32 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.573 0 C-N-CA 115.6 -2.44 . . . . 0.11 109.636 169.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -57.23 13.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 117.949 2.574 . . . . 5.3399999999999999 117.949 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.92 -29.15 70.07 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.97 1.366 . . . . 1.95 112.191 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.541 ' HB2' HG12 ' A' ' 136' ' ' VAL . . . -91.2 -23.86 20.09 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 113.411 -1.722 . . . . 0.11 115.176 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -90.58 92.5 8.88 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 126.092 2.12 . . . . 1.9299999999999999 111.743 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.439 HG21 ' HG2' ' A' ' 143' ' ' GLN . 3.8 mp -94.08 -34.32 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 123.355 1.55 . . . . 0.45000000000000001 113.441 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -67.6 -31.61 71.77 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 113.448 -1.705 . . . . 1.1499999999999999 113.291 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.47 64.71 2.32 Favored Glycine 0 C--N 1.343 0.921 0 C-N-CA 117.583 -2.246 . . . . 1.1499999999999999 114.101 -176.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -119.7 -10.39 9.58 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 125.259 1.211 . . . . 2.4900000000000002 113.731 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 21.52 47.07 Favored Glycine 0 C--N 1.354 1.547 0 N-CA-C 116.962 1.545 . . . . 0.39000000000000001 116.962 -174.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -155.22 164.25 39.07 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.04 1.736 . . . . 2.5499999999999998 108.564 -175.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.541 HG12 ' HB2' ' A' ' 128' ' ' ALA . 97.4 t -115.31 121.68 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 C-N-CA 116.629 -2.029 . . . . 0.34999999999999998 107.883 -178.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -109.26 173.88 6.12 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 115.26 -2.576 . . . . 3.0299999999999998 114.477 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -64.63 -35.38 80.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 123.998 1.856 . . . . 20.0 114.441 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -62.78 -44.68 95.53 Favored 'General case' 0 CA--C 1.492 -1.273 0 CA-C-N 111.69 -2.504 . . . . 2.8999999999999999 110.311 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.515 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 70.3 mt-10 -62.66 -30.65 71.54 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 110.971 -2.831 . . . . 2.77 114.023 172.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -58.02 -37.53 74.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 124.494 2.093 . . . . 0.38 112.749 171.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.99 -49.71 54.08 Favored 'Isoleucine or valine' 0 C--N 1.345 0.397 0 CA-C-N 112.277 -2.238 . . . . 0.40000000000000002 112.363 169.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.439 ' HG2' HG21 ' A' ' 130' ' ' ILE . 0.4 OUTLIER -58.06 -26.71 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.616 1.339 . . . . 2.25 114.616 -177.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.0 ttp -77.11 -49.74 14.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 122.993 1.377 . . . . 0.79000000000000004 111.657 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 mtt -77.22 -52.4 9.29 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 115.883 -2.327 . . . . 0.35999999999999999 114.627 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.3 m -57.72 -53.38 58.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 113.117 -1.856 . . . . 0.81999999999999995 112.736 174.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.62 -168.7 0.1 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 125.342 1.651 . . . . 1.28 111.911 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? . . . . . 0 C--N 1.348 0.519 0 CA-C-N 115.498 -0.774 . . . . 20.0 112.138 -177.517 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 CA--C 1.48 -1.744 0 CA-C-O 119.614 -0.232 . . . . 20.0 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -65.22 -35.69 81.84 Favored 'General case' 0 C--O 1.217 -0.655 0 O-C-N 126.337 2.273 . . . . 2.2200000000000002 112.268 171.417 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 5.8 mm-40 -53.83 -55.33 27.62 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 126.056 2.836 . . . . 2.2799999999999998 112.295 -176.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.4 pt -72.21 -52.18 25.81 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 111.214 -2.721 . . . . 0.29999999999999999 114.288 175.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.431 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -75.19 -54.99 6.18 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 117.301 -1.76 . . . . 3.2799999999999998 114.206 -174.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 83' ' ' GLU . 21.1 tt0 -67.11 -34.69 78.14 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 117.962 -1.495 . . . . 3.0499999999999998 114.882 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.7 -40.83 98.35 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 112.781 -3.568 . . . . 0.070000000000000007 109.918 168.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.62 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 83.2 t80 -53.95 -31.55 50.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.744 1.757 . . . . 0.11 115.744 168.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -67.75 -36.93 81.43 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 117.651 -1.62 . . . . 5.8399999999999999 112.618 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.57 -33.21 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 118.004 -1.478 . . . . 0.11 112.618 170.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.62 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.3 m-30 -59.95 -49.92 75.78 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 112.731 -2.031 . . . . 0.20999999999999999 110.99 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -78.27 78.17 4.75 Favored 'General case' 0 CA--C 1.509 -0.619 0 O-C-N 125.813 1.946 . . . . 1.46 110.203 170.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -57.76 -29.68 65.01 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 112.361 -2.2 . . . . 4.7599999999999998 114.605 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.419 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 19.9 p30 -89.15 -18.06 27.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 112.646 -2.07 . . . . 3.1000000000000001 114.229 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 71.68 17.43 76.59 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 117.575 -2.25 . . . . 0.46000000000000002 112.849 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.443 HD21 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -65.28 -8.86 19.86 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 115.813 1.783 . . . . 1.5700000000000001 115.813 -177.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.443 ' N ' HD21 ' A' ' 97' ' ' ASN . . . 88.74 -29.32 5.89 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 116.121 1.209 . . . . 0.23999999999999999 116.121 -173.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.412 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 42.8 m-85 -110.43 146.79 35.27 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 113.4 -1.4 . . . . 20.0 111.79 -175.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.419 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 32.4 mm -114.95 132.18 64.95 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 CA-C-N 112.225 -2.261 . . . . 0.31 110.231 -177.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -103.78 167.99 9.43 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 113.856 -3.137 . . . . 0.91000000000000003 110.907 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -48.63 -42.65 34.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 127.528 3.537 . . . . 0.11 113.225 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.417 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -51.84 -41.7 62.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.572 -2.558 . . . . 0.12 115.284 174.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.546 ' O ' HG12 ' A' ' 108' ' ' VAL . 2.5 mt-10 -76.8 -28.79 55.74 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 113.618 -1.628 . . . . 0.81000000000000005 114.927 173.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.574 HD23 HG11 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -56.05 -29.03 59.87 Favored 'General case' 0 C--O 1.221 -0.419 0 O-C-N 124.91 1.381 . . . . 0.16 111.956 168.669 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.95 ' NH2' ' OD1' ' A' ' 118' ' ' ASP . 35.1 ttm-85 -74.25 -34.24 63.55 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 114.296 -1.32 . . . . 4.3499999999999996 113.244 171.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.496 ' O ' ' HB ' ' A' ' 110' ' ' THR . 12.3 t-160 -61.37 -46.47 90.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 116.421 -2.112 . . . . 0.70999999999999996 111.006 172.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.563 HG21 ' O ' ' A' ' 105' ' ' LEU . 1.1 m -59.19 -38.52 74.81 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 113.74 -1.573 . . . . 0.10000000000000001 110.814 175.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.51 ' SD ' ' HG ' ' A' ' 116' ' ' LEU . 2.0 mmt -58.18 -40.5 81.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 124.616 2.151 . . . . 0.12 114.493 173.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.53 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 52.8 m -52.98 -47.44 68.2 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 113.056 -1.884 . . . . 0.59999999999999998 112.733 171.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -62.08 -38.01 87.18 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 126.958 2.661 . . . . 1.25 114.028 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.73 -14.46 52.58 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 113.355 -1.748 . . . . 0.45000000000000001 111.937 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.11 -36.95 3.91 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 118.176 -1.964 . . . . 0.40999999999999998 110.825 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 109' ' ' MET . 1.4 mt-10 -106.65 110.12 22.22 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 112.717 -1.741 . . . . 2.29 109.377 -173.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.53 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 33.8 mttp -94.44 119.95 33.93 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 116.153 -2.219 . . . . 2.2599999999999998 110.036 177.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.563 HD13 ' HE1' ' A' ' 124' ' ' MET . 14.0 mt -95.53 161.0 14.24 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 114.424 -2.91 . . . . 3.77 109.893 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.5 p -76.39 176.98 7.7 Favored 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 117.378 -1.729 . . . . 0.51000000000000001 111.751 -174.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.95 ' OD1' ' NH2' ' A' ' 106' ' ' ARG . 1.5 m-20 -50.8 -39.19 52.19 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 115.061 1.504 . . . . 1.6000000000000001 115.061 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.76 -54.05 39.38 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-O 125.928 2.775 . . . . 1.75 110.493 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.68 -33.83 76.52 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 109.724 -3.398 . . . . 0.68000000000000005 113.343 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 117' ' ' THR . 94.3 t -56.09 -35.67 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 123.517 1.627 . . . . 0.44 114.694 171.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -64.3 -44.22 92.31 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 112.306 -2.225 . . . . 1.29 111.804 170.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.68 -29.3 66.52 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 117.317 -1.753 . . . . 3.1899999999999999 114.077 168.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.563 ' HE1' HD13 ' A' ' 116' ' ' LEU . 39.4 mtt -68.76 -32.27 71.9 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 117.857 -1.068 . . . . 1.8100000000000001 112.176 176.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 37.8 mt -55.99 -51.02 65.98 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 117.132 -1.827 . . . . 0.11 108.666 166.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.579 ' C ' HH11 ' A' ' 126' ' ' ARG . 0.0 OUTLIER -54.6 -60.78 2.88 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 116.653 -2.019 . . . . 5.3399999999999999 113.825 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.413 ' HA ' ' NH1' ' A' ' 126' ' ' ARG . 6.7 tp10 -61.76 -25.71 67.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.482 2.087 . . . . 1.95 113.726 -174.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.537 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -91.54 -23.19 20.0 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 113.001 -1.909 . . . . 0.11 115.381 176.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -92.27 93.39 8.63 Favored 'General case' 0 CA--C 1.523 -0.09 0 O-C-N 126.12 2.138 . . . . 1.9299999999999999 110.096 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.3 mp -95.66 -34.47 5.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 114.392 -1.276 . . . . 0.45000000000000001 113.245 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -66.64 -31.15 71.66 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 113.185 -1.825 . . . . 1.1499999999999999 113.3 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.45 64.75 2.41 Favored Glycine 0 C--N 1.344 0.982 0 C-N-CA 117.996 -2.049 . . . . 1.1499999999999999 113.6 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 p-10 -118.44 -12.2 9.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.254 -0.973 . . . . 2.4900000000000002 113.611 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.83 19.27 48.34 Favored Glycine 0 C--N 1.355 1.614 0 N-CA-C 117.018 1.567 . . . . 0.39000000000000001 117.018 -174.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -152.7 165.09 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.864 1.666 . . . . 2.5499999999999998 108.477 -175.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.574 HG11 HD23 ' A' ' 105' ' ' LEU . 84.4 t -114.43 122.0 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 O-C-N 126.181 2.176 . . . . 0.34999999999999998 108.349 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -109.59 174.51 5.83 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 114.239 -2.985 . . . . 3.0299999999999998 112.581 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.44 ' HD2' ' OE2' ' A' ' 139' ' ' GLU . 34.3 t80 -65.51 -36.9 85.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.425 1.583 . . . . 20.0 113.875 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.44 ' OE2' ' HD2' ' A' ' 138' ' ' TYR . 12.7 mm-40 -62.56 -46.07 90.03 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 111.83 -2.441 . . . . 2.8999999999999999 109.94 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.537 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 71.3 mt-10 -63.21 -30.64 71.74 Favored 'General case' 0 CA--C 1.501 -0.921 0 CA-C-N 111.252 -2.704 . . . . 2.77 114.468 172.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.544 ' O ' ' HG3' ' A' ' 145' ' ' MET . 10.0 t80 -58.68 -38.07 77.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 124.195 1.95 . . . . 0.38 111.954 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.436 ' HB ' ' O ' ' A' ' 139' ' ' GLU . 86.8 t -69.32 -47.55 72.72 Favored 'Isoleucine or valine' 0 C--N 1.344 0.365 0 CA-C-N 112.928 -1.942 . . . . 0.40000000000000002 111.182 171.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.21 -30.53 64.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.522 1.304 . . . . 2.25 114.522 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.1 ttp -77.78 -46.52 21.4 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 123.792 1.758 . . . . 0.79000000000000004 111.379 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.544 ' HG3' ' O ' ' A' ' 141' ' ' PHE . 2.0 mtt -76.83 -52.34 9.68 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 115.833 -2.347 . . . . 0.35999999999999999 113.467 -179.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.5 m -58.79 -52.04 67.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 112.274 -2.239 . . . . 0.81999999999999995 112.834 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.68 -162.41 0.18 Allowed 'General case' 0 C--O 1.233 0.223 0 O-C-N 125.064 1.477 . . . . 1.28 111.128 -178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 12.5 tptt . . . . . 0 C--N 1.344 0.345 0 CA-C-O 118.334 -0.841 . . . . 20.0 111.51 179.827 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 . . . . . 0 CA--C 1.492 -1.271 0 N-CA-C 108.237 -1.023 . . . . 20.0 108.237 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -65.73 -33.59 76.24 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 125.909 2.006 . . . . 2.2200000000000002 113.957 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 48.8 mm-40 -52.75 -55.82 20.05 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-O 125.955 2.788 . . . . 2.2799999999999998 112.068 -178.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 pt -73.92 -48.73 37.65 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 CA-C-N 111.272 -2.695 . . . . 0.29999999999999999 114.461 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.435 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -76.46 -55.57 5.42 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 117.764 -1.574 . . . . 3.2799999999999998 113.894 -174.731 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -63.91 -41.1 97.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.149 -1.387 . . . . 3.0499999999999998 112.862 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.42 -37.97 87.89 Favored 'General case' 0 C--O 1.213 -0.866 0 C-N-CA 113.009 -3.477 . . . . 0.070000000000000007 110.04 172.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.577 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.7 t80 -54.71 -30.32 55.63 Favored 'General case' 0 C--N 1.349 0.567 0 N-CA-C 116.053 1.871 . . . . 0.11 116.053 167.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -67.88 -39.69 83.64 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 117.585 -1.646 . . . . 5.8399999999999999 111.894 174.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 27.4 t -67.71 -29.88 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 118.192 -1.403 . . . . 0.11 112.926 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.577 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -63.03 -50.92 68.78 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 113.372 -1.74 . . . . 0.20999999999999999 110.358 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -80.58 79.09 7.25 Favored 'General case' 0 CA--C 1.51 -0.564 0 O-C-N 126.303 2.252 . . . . 1.46 110.716 168.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -55.71 -33.69 64.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 111.12 -2.764 . . . . 4.7599999999999998 114.317 -174.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.427 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 22.8 p-10 -90.11 -17.89 26.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 112.781 -2.008 . . . . 3.1000000000000001 113.231 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.97 23.46 77.02 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 117.701 -2.19 . . . . 0.46000000000000002 111.939 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.447 HD21 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.92 -9.74 17.12 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 115.469 1.655 . . . . 1.5700000000000001 115.469 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.447 ' N ' HD21 ' A' ' 97' ' ' ASN . . . 87.19 -26.69 6.68 Favored Glycine 0 C--N 1.348 1.239 0 N-CA-C 116.413 1.325 . . . . 0.23999999999999999 116.413 -171.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.427 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 41.9 m-85 -110.56 145.19 38.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 123.351 1.548 . . . . 20.0 111.845 -176.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.436 HD12 ' CE1' ' A' ' 89' ' ' PHE . 27.6 mm -105.43 131.53 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 112.482 -2.145 . . . . 0.31 110.068 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -101.75 162.21 13.07 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 113.982 -3.087 . . . . 0.91000000000000003 109.762 170.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.513 ' HB2' HG13 ' A' ' 121' ' ' VAL . . . -49.26 -42.91 42.3 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 127.453 3.502 . . . . 0.11 112.246 173.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.97 -37.22 68.75 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 111.891 -2.413 . . . . 0.12 114.641 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.454 ' O ' HG12 ' A' ' 108' ' ' VAL . 2.5 tt0 -74.74 -29.26 61.1 Favored 'General case' 0 CA--C 1.495 -1.173 0 CA-C-N 113.638 -1.619 . . . . 0.81000000000000005 114.146 174.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.514 HD22 ' HE2' ' A' ' 144' ' ' MET . 0.2 OUTLIER -53.88 -52.62 59.88 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 117.283 -1.767 . . . . 0.16 109.398 170.559 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.439 ' HE ' HG22 ' A' ' 121' ' ' VAL . 22.7 ttp85 -52.91 -32.64 46.42 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 115.255 1.576 . . . . 4.3499999999999996 115.255 173.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -59.29 -54.15 50.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 116.769 -1.973 . . . . 0.70999999999999996 112.805 170.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.54 ' O ' HD23 ' A' ' 112' ' ' LEU . 0.9 OUTLIER -55.45 -35.3 37.04 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 125.33 1.644 . . . . 0.10000000000000001 111.54 176.549 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.592 ' HE1' 'CL ' ' A' ' 150' ' ' HLT . 35.8 mmm -64.01 -41.71 97.37 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 123.461 1.601 . . . . 0.12 113.161 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.3 m -57.1 -43.34 82.15 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 113.617 -1.629 . . . . 0.59999999999999998 112.872 171.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -60.72 -38.85 86.45 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 123.821 1.772 . . . . 1.25 113.207 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.54 HD23 ' O ' ' A' ' 108' ' ' VAL . 3.2 mm? -68.46 -8.24 39.09 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 112.402 -2.181 . . . . 0.45000000000000001 112.254 179.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.43 -40.24 2.53 Favored Glycine 0 C--N 1.342 0.906 0 C-N-CA 118.229 -1.939 . . . . 0.40999999999999998 110.854 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.516 ' O ' ' HB3' ' A' ' 109' ' ' MET . 20.0 mm-40 -97.6 117.71 32.49 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-N 112.451 -1.874 . . . . 2.29 111.524 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -109.96 116.03 30.87 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 117.62 -1.632 . . . . 2.2599999999999998 110.657 -176.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.431 HD12 ' HE3' ' A' ' 124' ' ' MET . 2.6 mp -95.84 152.51 18.43 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 116.098 -2.241 . . . . 3.77 109.187 -178.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 121' ' ' VAL . 81.2 p -74.76 175.91 7.52 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 117.764 -1.574 . . . . 0.51000000000000001 112.641 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.448 ' O ' ' HB ' ' A' ' 121' ' ' VAL . 56.0 m-20 -50.82 -37.8 45.02 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.017 1.488 . . . . 1.6000000000000001 115.017 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -54.62 -48.7 71.91 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-O 124.536 2.112 . . . . 1.75 112.54 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.418 ' O ' ' SD ' ' A' ' 124' ' ' MET . 6.4 mm-40 -70.16 -39.05 75.54 Favored 'General case' 0 C--O 1.206 -1.21 0 CA-C-N 110.629 -2.987 . . . . 0.68000000000000005 111.073 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.602 ' O ' ' HB2' ' A' ' 124' ' ' MET . 80.1 t -51.82 -35.24 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 124.13 1.919 . . . . 0.44 114.556 173.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.84 -44.37 90.01 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.073 -2.251 . . . . 1.29 112.818 169.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -56.92 -28.07 61.6 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 118.475 -1.29 . . . . 3.1899999999999999 114.149 168.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.602 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -62.63 -42.36 99.55 Favored 'General case' 0 CA--C 1.484 -1.588 0 CA-C-O 117.34 -1.314 . . . . 1.8100000000000001 111.023 172.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.462 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 17.1 mt -53.92 -46.23 64.27 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.583 0 C-N-CA 116.879 -1.929 . . . . 0.11 110.217 170.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -57.39 13.24 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 115.496 -2.482 . . . . 5.3399999999999999 116.032 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -65.31 -27.5 68.65 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 124.835 2.255 . . . . 1.95 113.602 -176.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.55 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -90.45 -25.99 20.06 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 112.399 -2.182 . . . . 0.11 114.402 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -89.59 90.83 8.43 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 126.814 2.571 . . . . 1.9299999999999999 111.333 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.6 mp -94.66 -33.74 5.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 122.645 1.212 . . . . 0.45000000000000001 113.293 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.0 p30 -66.36 -32.6 74.09 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 113.243 -1.798 . . . . 1.1499999999999999 113.012 174.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.56 65.06 2.14 Favored Glycine 0 C--N 1.345 1.038 0 C-N-CA 116.868 -2.587 . . . . 1.1499999999999999 113.677 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -119.94 -11.02 9.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 113.253 -1.473 . . . . 2.4900000000000002 113.68 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.38 19.78 51.14 Favored Glycine 0 C--N 1.354 1.534 0 N-CA-C 116.549 1.38 . . . . 0.39000000000000001 116.549 -174.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -154.13 162.9 40.88 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.007 1.723 . . . . 2.5499999999999998 107.81 -173.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.436 HG12 ' HB2' ' A' ' 128' ' ' ALA . 97.3 t -113.96 119.85 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.676 0 C-N-CA 115.251 -2.579 . . . . 0.34999999999999998 107.218 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -106.71 179.97 4.11 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 114.111 -3.036 . . . . 3.0299999999999998 114.293 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -68.41 -33.86 74.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 124.185 1.945 . . . . 20.0 114.353 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -61.66 -47.63 84.5 Favored 'General case' 0 CA--C 1.492 -1.282 0 CA-C-N 110.634 -2.985 . . . . 2.8999999999999999 110.162 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.55 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 80.8 mt-10 -63.38 -30.78 71.85 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-N 111.308 -2.678 . . . . 2.77 114.178 172.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -56.62 -39.21 73.22 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 124.285 1.993 . . . . 0.38 112.458 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.38 -47.63 76.73 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 CA-C-N 111.995 -2.366 . . . . 0.40000000000000002 111.908 170.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -60.9 -26.61 67.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.903 1.446 . . . . 2.25 114.903 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.514 ' HE2' HD22 ' A' ' 105' ' ' LEU . 4.7 ttm -74.42 -53.46 9.52 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 124.958 2.314 . . . . 0.79000000000000004 110.587 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 28.1 mtt -76.66 -50.84 12.74 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 115.823 -2.351 . . . . 0.35999999999999999 114.143 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.0 m -60.78 -56.53 20.16 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 112.937 -1.938 . . . . 0.81999999999999995 112.37 176.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.25 -167.21 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 O-C-N 124.842 1.339 . . . . 1.28 112.101 -177.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 10.2 tptt . . . . . 0 C--N 1.346 0.431 0 CA-C-O 118.175 -0.917 . . . . 20.0 112.12 -179.41 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' HLT . . . . . 0.592 'CL ' ' HE1' ' A' ' 109' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 CA--C 1.496 -1.102 0 CA-C-O 117.785 -1.102 . . . . 20.0 108.132 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.59 -33.03 74.97 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 125.743 1.902 . . . . 2.2200000000000002 114.118 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.2 mm-40 -53.59 -56.9 13.19 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 126.24 2.924 . . . . 2.2799999999999998 112.182 -178.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.7 pt -72.16 -50.33 37.34 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 CA-C-N 111.256 -2.702 . . . . 0.29999999999999999 114.207 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.41 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -73.55 -56.67 4.72 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.053 -1.43 . . . . 3.2799999999999998 113.897 -174.302 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.02 -37.29 81.22 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 113.846 -1.525 . . . . 3.0499999999999998 113.851 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.67 -38.32 89.86 Favored 'General case' 0 C--O 1.213 -0.831 0 C-N-CA 113.277 -3.369 . . . . 0.070000000000000007 109.702 169.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.587 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.8 t80 -56.91 -29.76 63.33 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 115.643 1.72 . . . . 0.11 115.643 168.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -67.81 -39.49 83.95 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 117.344 -1.742 . . . . 5.8399999999999999 112.035 176.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.75 -32.82 58.32 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 114.057 -1.429 . . . . 0.11 111.991 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.589 ' HB3' HG13 ' A' ' 108' ' ' VAL . 18.7 m-30 -60.52 -49.25 78.32 Favored 'General case' 0 CA--C 1.497 -1.078 0 O-C-N 125.745 1.903 . . . . 0.20999999999999999 111.635 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -78.99 80.28 5.34 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.325 2.012 . . . . 1.46 109.681 169.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -56.82 -30.56 63.87 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 111.409 -2.632 . . . . 4.7599999999999998 113.568 -171.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.405 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 13.5 p30 -90.43 -18.33 25.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 113.095 -1.866 . . . . 3.1000000000000001 113.896 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.17 15.89 76.81 Favored Glycine 0 C--N 1.343 0.927 0 C-N-CA 116.802 -2.618 . . . . 0.46000000000000002 113.103 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.451 HD21 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -64.92 -10.5 29.37 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.011 1.856 . . . . 1.5700000000000001 116.011 -177.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.451 ' N ' HD21 ' A' ' 97' ' ' ASN . . . 90.59 -29.07 7.0 Favored Glycine 0 C--N 1.347 1.178 0 N-CA-C 116.113 1.205 . . . . 0.23999999999999999 116.113 -172.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -110.07 146.35 35.54 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 113.581 -1.309 . . . . 20.0 111.696 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.458 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 37.9 mm -109.26 130.47 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 CA-C-N 112.641 -2.072 . . . . 0.31 110.881 -179.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 t -101.43 163.21 12.39 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 114.486 -2.885 . . . . 0.91000000000000003 108.955 171.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.466 ' HB2' HG13 ' A' ' 121' ' ' VAL . . . -50.43 -42.5 54.08 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 127.825 3.678 . . . . 0.11 112.11 176.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -53.58 -37.7 63.21 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.604 -2.544 . . . . 0.12 114.778 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.533 ' O ' HG12 ' A' ' 108' ' ' VAL . 1.7 mt-10 -74.69 -30.52 61.59 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 115.512 1.671 . . . . 0.81000000000000005 115.512 172.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.638 HD13 ' HG3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -55.65 -35.85 66.4 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 115.825 -2.35 . . . . 0.16 111.673 170.433 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.401 ' NH1' ' OD1' ' A' ' 118' ' ' ASP . 64.4 ttt180 -67.83 -30.47 69.88 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 113.957 -1.474 . . . . 4.3499999999999996 113.913 172.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.4 t60 -62.32 -50.3 72.18 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 116.979 -1.888 . . . . 0.70999999999999996 111.142 171.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.589 HG13 ' HB3' ' A' ' 92' ' ' PHE . 0.9 OUTLIER -55.42 -40.59 58.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 CA-C-N 113.623 -1.626 . . . . 0.10000000000000001 110.687 177.756 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.511 ' SD ' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -60.41 -39.71 88.37 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 125.633 2.635 . . . . 0.12 113.466 174.423 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 19.9 m -53.83 -47.99 70.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 112.871 -1.968 . . . . 0.59999999999999998 113.413 171.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -61.91 -37.23 83.86 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 126.559 2.412 . . . . 1.25 112.96 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.9 mm? -63.55 -11.59 25.68 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 113.874 -1.512 . . . . 0.45000000000000001 111.781 176.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.05 -34.83 4.94 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 118.637 -1.744 . . . . 0.40999999999999998 110.36 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 109' ' ' MET . 23.7 mt-10 -108.23 108.45 19.49 Favored 'General case' 0 C--O 1.215 -0.741 0 CA-C-N 112.888 -1.656 . . . . 2.29 109.093 -173.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -89.34 135.52 33.54 Favored 'General case' 0 CA--C 1.498 -1.026 0 C-N-CA 116.44 -2.104 . . . . 2.2599999999999998 110.895 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.511 HD23 ' SD ' ' A' ' 109' ' ' MET . 1.3 mm? -101.4 155.67 17.92 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 126.534 2.396 . . . . 3.77 109.582 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.534 ' O ' HG23 ' A' ' 121' ' ' VAL . 74.0 p -78.14 170.25 16.92 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 116.592 -2.043 . . . . 0.51000000000000001 112.044 -173.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.401 ' OD1' ' NH1' ' A' ' 106' ' ' ARG . 50.1 m-20 -55.04 -31.72 61.31 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 114.662 1.356 . . . . 1.6000000000000001 114.662 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.42 -48.42 81.72 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 125.268 2.461 . . . . 1.75 112.018 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.486 ' O ' ' SD ' ' A' ' 124' ' ' MET . 48.5 mm-40 -67.01 -39.06 86.98 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 109.543 -3.48 . . . . 0.68000000000000005 111.472 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.648 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.1 t -53.34 -33.87 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 124.371 2.034 . . . . 0.44 114.021 174.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -68.54 -41.81 79.31 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 115.938 -2.305 . . . . 1.29 112.921 170.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -56.96 -26.76 60.39 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 118.092 -1.443 . . . . 3.1899999999999999 114.385 167.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.648 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -64.21 -40.51 96.2 Favored 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 115.371 -0.831 . . . . 1.8100000000000001 111.003 173.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 22.0 mt -53.51 -48.5 58.14 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.439 0 C-N-CA 116.036 -2.266 . . . . 0.11 110.08 168.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -54.53 45.66 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 116.668 2.099 . . . . 5.3399999999999999 116.668 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.4 -28.06 68.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 123.478 1.609 . . . . 1.95 112.611 -176.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.51 ' HB2' HG12 ' A' ' 136' ' ' VAL . . . -92.28 -25.4 18.61 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 113.161 -1.836 . . . . 0.11 115.047 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -89.4 92.44 9.14 Favored 'General case' 0 C--N 1.338 0.085 0 O-C-N 126.729 2.518 . . . . 1.9299999999999999 111.181 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.22 -32.26 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 123.125 1.441 . . . . 0.45000000000000001 113.354 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -69.08 -30.96 69.39 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 112.832 -1.985 . . . . 1.1499999999999999 113.632 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.14 63.46 2.66 Favored Glycine 0 C--N 1.345 1.065 0 C-N-CA 117.389 -2.339 . . . . 1.1499999999999999 114.173 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -118.54 -12.17 9.82 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 113.294 -1.453 . . . . 2.4900000000000002 113.586 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.17 22.3 38.61 Favored Glycine 0 C--N 1.35 1.347 0 N-CA-C 116.635 1.414 . . . . 0.39000000000000001 116.635 -175.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -155.98 163.93 39.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.775 1.63 . . . . 2.5499999999999998 108.267 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.51 HG12 ' HB2' ' A' ' 128' ' ' ALA . 90.2 t -115.26 119.36 61.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 116.316 -2.153 . . . . 0.34999999999999998 108.277 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -105.29 173.76 6.17 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 115.959 -2.297 . . . . 3.0299999999999998 114.142 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -64.77 -36.56 84.71 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 124.274 1.988 . . . . 20.0 114.276 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.96 -45.5 94.48 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 111.351 -2.659 . . . . 2.8999999999999999 110.51 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.507 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 64.4 mt-10 -64.63 -31.63 72.94 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-N 110.5 -3.046 . . . . 2.77 114.445 172.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.479 ' CE1' ' HE3' ' A' ' 145' ' ' MET . 9.1 t80 -56.88 -40.7 76.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.953 1.835 . . . . 0.38 111.445 173.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.449 HG12 ' HG1' ' A' ' 146' ' ' THR . 78.4 t -65.87 -46.45 88.54 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 CA-C-N 112.802 -1.999 . . . . 0.40000000000000002 112.326 170.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -57.71 -33.97 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 114.333 1.234 . . . . 2.25 114.333 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.941 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 14.9 ttp -76.95 -48.04 19.22 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 123.796 1.76 . . . . 0.79000000000000004 111.673 -178.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.815 ' HE1' ' HE3' ' A' ' 144' ' ' MET . 17.5 mmt -72.15 -56.86 4.86 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.53 -2.068 . . . . 0.35999999999999999 112.452 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' THR . . . . . 0.449 ' HG1' HG12 ' A' ' 142' ' ' VAL . 17.4 m -60.31 -56.33 22.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 111.849 -2.432 . . . . 0.81999999999999995 112.885 178.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 57.03 -163.63 0.17 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.396 -1.274 . . . . 1.28 112.031 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.344 0.333 0 CA-C-N 115.19 -0.914 . . . . 20.0 111.625 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' HLT . . . . . 0.941 'BR ' ' SD ' ' A' ' 144' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 107.861 -1.162 . . . . 20.0 107.861 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.44 ' HB2' ' HB3' ' A' ' 87' ' ' GLU . 2.1 pp20? -67.32 -33.44 75.26 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 126.223 2.202 . . . . 2.2200000000000002 112.905 174.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.1 mm-40 -53.76 -54.18 41.76 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 125.231 2.443 . . . . 2.2799999999999998 112.864 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.6 pt -73.38 -49.41 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 114.67 -2.812 . . . . 0.29999999999999999 114.489 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -53.06 8.31 Favored 'General case' 0 C--O 1.206 -1.187 0 C-N-CA 118.327 -1.349 . . . . 3.2799999999999998 113.892 -174.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.44 ' HB3' ' HB2' ' A' ' 83' ' ' GLU . 16.6 tt0 -70.35 -35.53 73.63 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 114.654 1.353 . . . . 3.0499999999999998 114.654 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -63.0 -39.22 94.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 113.434 -3.307 . . . . 0.070000000000000007 109.981 166.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.581 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 84.8 t80 -56.17 -30.41 62.19 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.25 1.574 . . . . 0.11 115.25 169.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -37.64 77.92 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 115.683 -2.407 . . . . 5.8399999999999999 110.553 176.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.1 t -65.1 -34.55 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 116.624 -2.03 . . . . 0.11 113.238 173.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.581 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.1 m-30 -61.23 -48.54 80.98 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 112.103 -2.317 . . . . 0.20999999999999999 111.228 -178.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -76.42 76.61 3.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 125.034 2.35 . . . . 1.46 111.368 166.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -60.05 -30.09 68.97 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 111.213 -2.721 . . . . 4.7599999999999998 115.314 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -85.4 -26.21 26.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 112.393 -2.185 . . . . 3.1000000000000001 112.418 175.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.76 27.08 73.69 Favored Glycine 0 C--N 1.344 1.001 0 CA-C-N 113.223 -1.808 . . . . 0.46000000000000002 111.685 178.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -68.19 -16.79 64.13 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 125.307 1.24 . . . . 1.5700000000000001 114.188 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.67 -14.7 64.46 Favored Glycine 0 C--N 1.343 0.962 0 O-C-N 125.422 1.701 . . . . 0.23999999999999999 113.743 -175.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -114.38 146.76 40.15 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.295 -1.453 . . . . 20.0 109.651 -173.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.9 mm -113.27 135.0 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.768 0 CA-C-N 112.669 -2.06 . . . . 0.31 110.078 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.0 t -107.4 159.72 16.18 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 116.242 -2.183 . . . . 0.91000000000000003 108.511 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HB2' HG13 ' A' ' 121' ' ' VAL . . . -46.19 -43.45 15.24 Favored 'General case' 0 CA--C 1.548 0.883 1 CA-C-O 128.513 4.006 . . . . 0.11 113.226 177.681 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -54.62 -46.83 73.95 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 110.717 -2.947 . . . . 0.12 115.201 174.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -28.15 69.73 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 115.356 1.613 . . . . 0.81000000000000005 115.356 172.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.557 ' HG ' ' HB3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -54.64 -50.65 67.62 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 117.185 -1.806 . . . . 0.16 111.0 167.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -54.76 -28.52 49.21 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 117.358 -1.737 . . . . 4.3499999999999996 115.256 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -62.86 -54.99 30.22 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 116.871 -1.932 . . . . 0.70999999999999996 111.806 171.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.551 ' O ' HD23 ' A' ' 112' ' ' LEU . 2.7 m -57.68 -33.42 45.0 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 116.728 -1.989 . . . . 0.10000000000000001 111.171 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.725 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 41.7 mmm -60.58 -44.52 96.11 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 123.292 1.52 . . . . 0.12 113.547 171.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.4 m -55.51 -45.18 77.14 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 113.62 -1.627 . . . . 0.59999999999999998 112.384 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -59.24 -41.86 89.71 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 123.615 1.674 . . . . 1.25 112.826 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.551 HD23 ' O ' ' A' ' 108' ' ' VAL . 1.6 mm? -64.44 -7.5 10.15 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 112.688 -2.051 . . . . 0.45000000000000001 112.363 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.8 -35.99 4.06 Favored Glycine 0 C--N 1.339 0.705 0 C-N-CA 117.835 -2.126 . . . . 0.40999999999999998 110.796 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 109' ' ' MET . 33.2 mm-40 -108.5 111.07 22.75 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.574 -1.813 . . . . 2.29 110.645 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -93.32 130.12 39.18 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 113.932 -1.485 . . . . 2.2599999999999998 111.056 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.585 HD23 ' HE1' ' A' ' 109' ' ' MET . 4.4 mm? -95.02 153.16 17.77 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 116.375 -2.13 . . . . 3.77 109.82 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.536 ' O ' HG23 ' A' ' 121' ' ' VAL . 44.6 p -76.21 169.57 17.96 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 113.725 -1.579 . . . . 0.51000000000000001 112.333 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -52.48 -33.92 46.83 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.702 1.371 . . . . 1.6000000000000001 114.702 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -52.31 65.99 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 126.751 3.167 . . . . 1.75 111.125 176.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 124' ' ' MET . 12.2 mm-40 -61.73 -35.71 78.86 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 109.286 -3.597 . . . . 0.68000000000000005 112.526 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.623 HG13 ' HB2' ' A' ' 102' ' ' ALA . 88.3 t -55.12 -36.33 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 123.5 1.619 . . . . 0.44 114.15 176.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.08 -44.9 78.88 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 112.415 -2.175 . . . . 1.29 111.628 172.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -57.4 -28.74 63.5 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 118.146 -1.421 . . . . 3.1899999999999999 114.281 168.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.755 ' HE2' 'BR ' ' A' ' 150' ' ' HLT . 25.9 mmt -65.96 -37.03 84.94 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 115.253 -0.885 . . . . 1.8100000000000001 110.709 178.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 14.3 mt -56.82 -50.23 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 116.151 -2.22 . . . . 0.11 109.736 168.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -37.73 73.79 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 116.029 1.863 . . . . 5.3399999999999999 116.029 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -78.72 -32.1 46.71 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-O 124.709 2.195 . . . . 1.95 112.226 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.491 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -89.08 -26.6 21.29 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 112.705 -2.043 . . . . 0.11 114.092 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -86.53 91.27 8.5 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 126.612 2.445 . . . . 1.9299999999999999 111.45 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.0 mp -95.5 -32.94 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-N 114.019 -1.446 . . . . 0.45000000000000001 112.791 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -67.83 -33.44 74.78 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 113.253 -1.794 . . . . 1.1499999999999999 113.73 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.09 64.57 2.28 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 118.179 -1.962 . . . . 1.1499999999999999 113.419 -176.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -119.48 -10.95 9.56 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 113.705 -1.248 . . . . 2.4900000000000002 113.595 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.39 22.72 39.57 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 116.616 1.406 . . . . 0.39000000000000001 116.616 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -156.3 164.87 37.8 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.084 1.354 . . . . 2.5499999999999998 107.668 -174.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.472 HG12 ' HB2' ' A' ' 128' ' ' ALA . 94.3 t -115.54 119.54 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 115.84 -2.344 . . . . 0.34999999999999998 107.133 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -104.78 175.14 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 116.001 -2.28 . . . . 3.0299999999999998 114.969 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.401 ' HD2' ' OE2' ' A' ' 139' ' ' GLU . 40.8 t80 -64.68 -35.2 80.27 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 123.279 1.514 . . . . 20.0 113.899 177.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.401 ' OE2' ' HD2' ' A' ' 138' ' ' TYR . 10.4 mm-40 -62.94 -46.75 86.28 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 111.962 -2.381 . . . . 2.8999999999999999 110.466 -178.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.491 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 60.8 mt-10 -60.44 -31.07 70.07 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 110.394 -3.094 . . . . 2.77 114.854 171.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.96 -41.16 74.3 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 124.204 1.955 . . . . 0.38 112.195 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.7 t -69.13 -49.69 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 112.239 -2.255 . . . . 0.40000000000000002 112.109 171.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -56.06 -27.35 53.04 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 114.205 -1.362 . . . . 2.25 114.671 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.459 ' HB3' ' HE3' ' A' ' 144' ' ' MET . 0.9 OUTLIER -75.87 -53.3 8.66 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 124.155 1.931 . . . . 0.79000000000000004 110.899 178.608 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 33.0 mtt -76.47 -54.29 6.93 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 114.614 -2.834 . . . . 0.35999999999999999 114.731 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 23.3 m -57.08 -59.74 4.63 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.345 -1.752 . . . . 0.81999999999999995 112.686 173.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 52.66 -159.09 0.13 Allowed 'General case' 0 C--N 1.345 0.376 0 O-C-N 124.884 1.365 . . . . 1.28 111.47 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt . . . . . 0 C--N 1.347 0.49 0 CA-C-O 118.462 -0.78 . . . . 20.0 111.052 175.074 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' HLT . . . . . 0.755 'BR ' ' HE2' ' A' ' 124' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 . . . . . 0 CA--C 1.502 -0.897 0 N-CA-C 106.95 -1.5 . . . . 20.0 106.95 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 0.0 OUTLIER -51.52 -37.13 47.88 Favored 'General case' 0 C--O 1.218 -0.571 0 O-C-N 125.895 1.997 . . . . 2.2200000000000002 114.013 168.75 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -50.63 -59.74 3.75 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 123.943 1.83 . . . . 2.2799999999999998 111.778 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.9 pt -73.02 -49.25 40.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 116.242 -2.183 . . . . 0.29999999999999999 115.481 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.43 -55.05 7.66 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 113.269 -1.787 . . . . 3.2799999999999998 113.948 -175.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -70.12 -35.27 73.99 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 117.9 -1.52 . . . . 3.0499999999999998 113.807 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.69 92.9 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 113.974 -3.091 . . . . 0.070000000000000007 109.305 170.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.544 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 76.4 t80 -56.45 -32.09 64.6 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 114.998 1.481 . . . . 0.11 114.998 168.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -65.96 -36.88 84.54 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 115.6 -2.44 . . . . 5.8399999999999999 113.521 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.1 t -70.26 -28.41 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 117.809 -1.556 . . . . 0.11 113.058 171.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.544 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.8 m-30 -63.03 -49.98 72.5 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 113.067 -1.879 . . . . 0.20999999999999999 111.571 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -76.5 79.32 3.2 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 126.959 2.662 . . . . 1.46 109.796 167.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -58.19 -30.46 66.47 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 111.435 -2.621 . . . . 4.7599999999999998 113.879 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.418 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 21.3 p-10 -91.48 -17.39 25.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 113.525 -1.671 . . . . 3.1000000000000001 113.756 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.66 20.47 79.63 Favored Glycine 0 C--N 1.343 0.931 0 C-N-CA 117.486 -2.292 . . . . 0.46000000000000002 112.828 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.426 HD21 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.66 -9.22 12.78 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 116.321 1.971 . . . . 1.5700000000000001 116.321 -178.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.426 ' N ' HD21 ' A' ' 97' ' ' ASN . . . 91.18 -31.3 5.75 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 124.821 1.326 . . . . 0.23999999999999999 115.056 -171.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -110.81 145.87 37.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 112.806 -1.697 . . . . 20.0 112.651 -172.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' A' ' 104' ' ' GLU . 13.6 mm -102.88 133.84 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-N 112.146 -2.297 . . . . 0.31 110.01 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.9 t -107.23 159.12 16.59 Favored 'General case' 0 CA--C 1.503 -0.832 0 C-N-CA 115.197 -2.601 . . . . 0.91000000000000003 108.017 170.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.444 ' HB2' HG13 ' A' ' 121' ' ' VAL . . . -47.53 -42.47 23.39 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 127.927 3.727 . . . . 0.11 112.141 178.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.07 87.42 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-N 111.593 -2.549 . . . . 0.12 115.174 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.579 ' OE1' HD13 ' A' ' 100' ' ' ILE . 4.4 tt0 -66.26 -25.46 66.89 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 114.986 1.476 . . . . 0.81000000000000005 114.986 171.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.989 HD11 'BR ' ' A' ' 150' ' ' HLT . 0.2 OUTLIER -56.33 -45.83 80.16 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 116.293 -2.163 . . . . 0.16 111.306 167.298 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 -55.8 -28.22 55.11 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.176 1.941 . . . . 4.3499999999999996 115.327 171.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 55.7 t60 -65.1 -52.2 56.86 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 116.313 -2.155 . . . . 0.70999999999999996 112.008 170.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.653 HG21 HD12 ' A' ' 105' ' ' LEU . 1.2 m -55.65 -36.68 43.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.834 0 C-N-CA 116.233 -2.187 . . . . 0.10000000000000001 111.612 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.789 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 50.0 mmm -60.24 -44.54 95.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 125.211 2.434 . . . . 0.12 113.581 173.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 80.8 m -51.1 -47.01 62.02 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 112.815 -1.993 . . . . 0.59999999999999998 113.053 170.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.41 -39.24 90.05 Favored 'General case' 0 C--O 1.216 -0.661 0 O-C-N 125.837 1.96 . . . . 1.25 113.443 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.6 mm? -67.08 -7.96 26.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 123.38 1.562 . . . . 0.45000000000000001 112.274 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 97.78 -37.92 3.29 Favored Glycine 0 C--N 1.342 0.865 0 C-N-CA 118.514 -1.803 . . . . 0.40999999999999998 110.8 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.514 ' O ' ' HB3' ' A' ' 109' ' ' MET . 74.4 mm-40 -105.79 116.12 31.4 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-N 112.196 -2.002 . . . . 2.29 109.363 -173.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -94.41 128.91 41.25 Favored 'General case' 0 CA--C 1.502 -0.89 0 C-N-CA 115.718 -2.393 . . . . 2.2599999999999998 111.239 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.563 ' HB2' ' HE2' ' A' ' 124' ' ' MET . 39.3 mt -93.2 157.89 16.04 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 116.193 -2.203 . . . . 3.77 109.949 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.6 p -81.02 175.09 10.99 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 117.312 -1.755 . . . . 0.51000000000000001 111.406 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -58.44 -29.97 66.55 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 114.725 1.38 . . . . 1.6000000000000001 114.725 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.72 -50.98 71.73 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-O 124.991 2.329 . . . . 1.75 111.095 175.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.48 ' O ' ' SD ' ' A' ' 124' ' ' MET . 17.6 mm-40 -63.51 -43.23 97.82 Favored 'General case' 0 C--O 1.207 -1.174 0 CA-C-N 109.716 -3.402 . . . . 0.68000000000000005 110.693 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.605 ' O ' ' HB2' ' A' ' 124' ' ' MET . 72.6 t -51.51 -34.7 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 124.468 2.08 . . . . 0.44 115.022 174.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -65.35 -45.6 83.54 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 116.402 -2.119 . . . . 1.29 112.021 170.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -56.06 -29.09 60.0 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.262 -1.375 . . . . 3.1899999999999999 114.008 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.605 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -63.07 -39.35 94.45 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 112.06 0.393 . . . . 1.8100000000000001 112.06 174.399 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 24.2 mt -53.91 -48.95 62.32 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.573 0 C-N-CA 115.6 -2.44 . . . . 0.11 109.636 169.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -57.23 13.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 117.949 2.574 . . . . 5.3399999999999999 117.949 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.92 -29.15 70.07 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.97 1.366 . . . . 1.95 112.191 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.541 ' HB2' HG12 ' A' ' 136' ' ' VAL . . . -91.2 -23.86 20.09 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 113.411 -1.722 . . . . 0.11 115.176 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -90.58 92.5 8.88 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 126.092 2.12 . . . . 1.9299999999999999 111.743 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.439 HG21 ' HG2' ' A' ' 143' ' ' GLN . 3.8 mp -94.08 -34.32 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 123.355 1.55 . . . . 0.45000000000000001 113.441 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -67.6 -31.61 71.77 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 113.448 -1.705 . . . . 1.1499999999999999 113.291 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.47 64.71 2.32 Favored Glycine 0 C--N 1.343 0.921 0 C-N-CA 117.583 -2.246 . . . . 1.1499999999999999 114.101 -176.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -119.7 -10.39 9.58 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 125.259 1.211 . . . . 2.4900000000000002 113.731 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 21.52 47.07 Favored Glycine 0 C--N 1.354 1.547 0 N-CA-C 116.962 1.545 . . . . 0.39000000000000001 116.962 -174.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -155.22 164.25 39.07 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.04 1.736 . . . . 2.5499999999999998 108.564 -175.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.541 HG12 ' HB2' ' A' ' 128' ' ' ALA . 97.4 t -115.31 121.68 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 C-N-CA 116.629 -2.029 . . . . 0.34999999999999998 107.883 -178.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -109.26 173.88 6.12 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 115.26 -2.576 . . . . 3.0299999999999998 114.477 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -64.63 -35.38 80.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 123.998 1.856 . . . . 20.0 114.441 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -62.78 -44.68 95.53 Favored 'General case' 0 CA--C 1.492 -1.273 0 CA-C-N 111.69 -2.504 . . . . 2.8999999999999999 110.311 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.515 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 70.3 mt-10 -62.66 -30.65 71.54 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 110.971 -2.831 . . . . 2.77 114.023 172.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -58.02 -37.53 74.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 124.494 2.093 . . . . 0.38 112.749 171.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.99 -49.71 54.08 Favored 'Isoleucine or valine' 0 C--N 1.345 0.397 0 CA-C-N 112.277 -2.238 . . . . 0.40000000000000002 112.363 169.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.439 ' HG2' HG21 ' A' ' 130' ' ' ILE . 0.4 OUTLIER -58.06 -26.71 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.616 1.339 . . . . 2.25 114.616 -177.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.682 ' SD ' 'CL ' ' A' ' 150' ' ' HLT . 6.0 ttp -77.11 -49.74 14.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 122.993 1.377 . . . . 0.79000000000000004 111.657 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 mtt -77.22 -52.4 9.29 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 115.883 -2.327 . . . . 0.35999999999999999 114.627 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.3 m -57.72 -53.38 58.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 113.117 -1.856 . . . . 0.81999999999999995 112.736 174.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.62 -168.7 0.1 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 125.342 1.651 . . . . 1.28 111.911 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? . . . . . 0 C--N 1.348 0.519 0 CA-C-N 115.498 -0.774 . . . . 20.0 112.138 -177.517 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' HLT . . . . . 0.989 'BR ' HD11 ' A' ' 105' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 CA--C 1.48 -1.744 0 CA-C-O 119.614 -0.232 . . . . 20.0 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -65.22 -35.69 81.84 Favored 'General case' 0 C--O 1.217 -0.655 0 O-C-N 126.337 2.273 . . . . 2.2200000000000002 112.268 171.417 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 5.8 mm-40 -53.83 -55.33 27.62 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 126.056 2.836 . . . . 2.2799999999999998 112.295 -176.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.4 pt -72.21 -52.18 25.81 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 111.214 -2.721 . . . . 0.29999999999999999 114.288 175.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.431 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -75.19 -54.99 6.18 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 117.301 -1.76 . . . . 3.2799999999999998 114.206 -174.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 83' ' ' GLU . 21.1 tt0 -67.11 -34.69 78.14 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 117.962 -1.495 . . . . 3.0499999999999998 114.882 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.7 -40.83 98.35 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 112.781 -3.568 . . . . 0.070000000000000007 109.918 168.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.62 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 83.2 t80 -53.95 -31.55 50.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.744 1.757 . . . . 0.11 115.744 168.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -67.75 -36.93 81.43 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 117.651 -1.62 . . . . 5.8399999999999999 112.618 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.57 -33.21 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 118.004 -1.478 . . . . 0.11 112.618 170.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.62 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.3 m-30 -59.95 -49.92 75.78 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 112.731 -2.031 . . . . 0.20999999999999999 110.99 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -78.27 78.17 4.75 Favored 'General case' 0 CA--C 1.509 -0.619 0 O-C-N 125.813 1.946 . . . . 1.46 110.203 170.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -57.76 -29.68 65.01 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 112.361 -2.2 . . . . 4.7599999999999998 114.605 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.419 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 19.9 p30 -89.15 -18.06 27.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 112.646 -2.07 . . . . 3.1000000000000001 114.229 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 71.68 17.43 76.59 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 117.575 -2.25 . . . . 0.46000000000000002 112.849 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.443 HD21 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -65.28 -8.86 19.86 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 115.813 1.783 . . . . 1.5700000000000001 115.813 -177.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.443 ' N ' HD21 ' A' ' 97' ' ' ASN . . . 88.74 -29.32 5.89 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 116.121 1.209 . . . . 0.23999999999999999 116.121 -173.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.412 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 42.8 m-85 -110.43 146.79 35.27 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 113.4 -1.4 . . . . 20.0 111.79 -175.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.419 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 32.4 mm -114.95 132.18 64.95 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 CA-C-N 112.225 -2.261 . . . . 0.31 110.231 -177.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -103.78 167.99 9.43 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 113.856 -3.137 . . . . 0.91000000000000003 110.907 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -48.63 -42.65 34.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 127.528 3.537 . . . . 0.11 113.225 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.417 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -51.84 -41.7 62.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.572 -2.558 . . . . 0.12 115.284 174.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.546 ' O ' HG12 ' A' ' 108' ' ' VAL . 2.5 mt-10 -76.8 -28.79 55.74 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 113.618 -1.628 . . . . 0.81000000000000005 114.927 173.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.574 HD23 HG11 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -56.05 -29.03 59.87 Favored 'General case' 0 C--O 1.221 -0.419 0 O-C-N 124.91 1.381 . . . . 0.16 111.956 168.669 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.95 ' NH2' ' OD1' ' A' ' 118' ' ' ASP . 35.1 ttm-85 -74.25 -34.24 63.55 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 114.296 -1.32 . . . . 4.3499999999999996 113.244 171.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.496 ' O ' ' HB ' ' A' ' 110' ' ' THR . 12.3 t-160 -61.37 -46.47 90.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 116.421 -2.112 . . . . 0.70999999999999996 111.006 172.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.563 HG21 ' O ' ' A' ' 105' ' ' LEU . 1.1 m -59.19 -38.52 74.81 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 113.74 -1.573 . . . . 0.10000000000000001 110.814 175.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.51 ' SD ' ' HG ' ' A' ' 116' ' ' LEU . 2.0 mmt -58.18 -40.5 81.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 124.616 2.151 . . . . 0.12 114.493 173.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.53 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 52.8 m -52.98 -47.44 68.2 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 113.056 -1.884 . . . . 0.59999999999999998 112.733 171.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -62.08 -38.01 87.18 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 126.958 2.661 . . . . 1.25 114.028 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.73 -14.46 52.58 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 113.355 -1.748 . . . . 0.45000000000000001 111.937 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.11 -36.95 3.91 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 118.176 -1.964 . . . . 0.40999999999999998 110.825 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 109' ' ' MET . 1.4 mt-10 -106.65 110.12 22.22 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 112.717 -1.741 . . . . 2.29 109.377 -173.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.53 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 33.8 mttp -94.44 119.95 33.93 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 116.153 -2.219 . . . . 2.2599999999999998 110.036 177.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.563 HD13 ' HE1' ' A' ' 124' ' ' MET . 14.0 mt -95.53 161.0 14.24 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 114.424 -2.91 . . . . 3.77 109.893 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.5 p -76.39 176.98 7.7 Favored 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 117.378 -1.729 . . . . 0.51000000000000001 111.751 -174.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.95 ' OD1' ' NH2' ' A' ' 106' ' ' ARG . 1.5 m-20 -50.8 -39.19 52.19 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 115.061 1.504 . . . . 1.6000000000000001 115.061 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.76 -54.05 39.38 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-O 125.928 2.775 . . . . 1.75 110.493 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.68 -33.83 76.52 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 109.724 -3.398 . . . . 0.68000000000000005 113.343 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 117' ' ' THR . 94.3 t -56.09 -35.67 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 123.517 1.627 . . . . 0.44 114.694 171.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -64.3 -44.22 92.31 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 112.306 -2.225 . . . . 1.29 111.804 170.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.68 -29.3 66.52 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 117.317 -1.753 . . . . 3.1899999999999999 114.077 168.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.563 ' HE1' HD13 ' A' ' 116' ' ' LEU . 39.4 mtt -68.76 -32.27 71.9 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 117.857 -1.068 . . . . 1.8100000000000001 112.176 176.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 37.8 mt -55.99 -51.02 65.98 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 117.132 -1.827 . . . . 0.11 108.666 166.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.579 ' C ' HH11 ' A' ' 126' ' ' ARG . 0.0 OUTLIER -54.6 -60.78 2.88 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 116.653 -2.019 . . . . 5.3399999999999999 113.825 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.413 ' HA ' ' NH1' ' A' ' 126' ' ' ARG . 6.7 tp10 -61.76 -25.71 67.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.482 2.087 . . . . 1.95 113.726 -174.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.537 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -91.54 -23.19 20.0 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 113.001 -1.909 . . . . 0.11 115.381 176.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -92.27 93.39 8.63 Favored 'General case' 0 CA--C 1.523 -0.09 0 O-C-N 126.12 2.138 . . . . 1.9299999999999999 110.096 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.3 mp -95.66 -34.47 5.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 114.392 -1.276 . . . . 0.45000000000000001 113.245 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -66.64 -31.15 71.66 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 113.185 -1.825 . . . . 1.1499999999999999 113.3 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.45 64.75 2.41 Favored Glycine 0 C--N 1.344 0.982 0 C-N-CA 117.996 -2.049 . . . . 1.1499999999999999 113.6 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 p-10 -118.44 -12.2 9.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.254 -0.973 . . . . 2.4900000000000002 113.611 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.83 19.27 48.34 Favored Glycine 0 C--N 1.355 1.614 0 N-CA-C 117.018 1.567 . . . . 0.39000000000000001 117.018 -174.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -152.7 165.09 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.864 1.666 . . . . 2.5499999999999998 108.477 -175.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.574 HG11 HD23 ' A' ' 105' ' ' LEU . 84.4 t -114.43 122.0 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 O-C-N 126.181 2.176 . . . . 0.34999999999999998 108.349 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -109.59 174.51 5.83 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 114.239 -2.985 . . . . 3.0299999999999998 112.581 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.44 ' HD2' ' OE2' ' A' ' 139' ' ' GLU . 34.3 t80 -65.51 -36.9 85.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.425 1.583 . . . . 20.0 113.875 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.44 ' OE2' ' HD2' ' A' ' 138' ' ' TYR . 12.7 mm-40 -62.56 -46.07 90.03 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 111.83 -2.441 . . . . 2.8999999999999999 109.94 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.537 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 71.3 mt-10 -63.21 -30.64 71.74 Favored 'General case' 0 CA--C 1.501 -0.921 0 CA-C-N 111.252 -2.704 . . . . 2.77 114.468 172.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.544 ' O ' ' HG3' ' A' ' 145' ' ' MET . 10.0 t80 -58.68 -38.07 77.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 124.195 1.95 . . . . 0.38 111.954 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.436 ' HB ' ' O ' ' A' ' 139' ' ' GLU . 86.8 t -69.32 -47.55 72.72 Favored 'Isoleucine or valine' 0 C--N 1.344 0.365 0 CA-C-N 112.928 -1.942 . . . . 0.40000000000000002 111.182 171.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.21 -30.53 64.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.522 1.304 . . . . 2.25 114.522 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.85 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 15.1 ttp -77.78 -46.52 21.4 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 123.792 1.758 . . . . 0.79000000000000004 111.379 -179.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.609 ' HE1' 'BR ' ' A' ' 150' ' ' HLT . 2.0 mtt -76.83 -52.34 9.68 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 115.833 -2.347 . . . . 0.35999999999999999 113.467 -179.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.5 m -58.79 -52.04 67.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 112.274 -2.239 . . . . 0.81999999999999995 112.834 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.68 -162.41 0.18 Allowed 'General case' 0 C--O 1.233 0.223 0 O-C-N 125.064 1.477 . . . . 1.28 111.128 -178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 12.5 tptt . . . . . 0 C--N 1.344 0.345 0 CA-C-O 118.334 -0.841 . . . . 20.0 111.51 179.827 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' HLT . . . . . 0.85 'BR ' ' SD ' ' A' ' 144' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 . . . . . 0 CA--C 1.492 -1.271 0 N-CA-C 108.237 -1.023 . . . . 1.97 108.237 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -65.73 -33.59 76.24 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 125.909 2.006 . . . . 2.22 113.957 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 48.8 mm-40 -52.75 -55.82 20.05 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-O 125.955 2.788 . . . . 2.28 112.068 -178.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 pt -73.92 -48.73 37.65 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 CA-C-N 111.272 -2.695 . . . . 0.3 114.461 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -76.46 -55.57 5.42 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 117.764 -1.574 . . . . 2.72 113.894 -174.731 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -63.91 -41.1 97.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.149 -1.387 . . . . 3.05 112.862 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.42 -37.97 87.89 Favored 'General case' 0 C--O 1.213 -0.866 0 C-N-CA 113.009 -3.477 . . . . 0.07 110.04 172.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.588 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.7 t80 -54.71 -30.32 55.63 Favored 'General case' 0 C--N 1.349 0.567 0 N-CA-C 116.053 1.871 . . . . 0.11 116.053 167.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -67.88 -39.69 83.64 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 117.585 -1.646 . . . . 4.69 111.894 174.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 27.4 t -67.71 -29.88 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 118.192 -1.403 . . . . 0.11 112.926 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.588 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -63.03 -50.92 68.78 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 113.372 -1.74 . . . . 0.21 110.358 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -80.58 79.09 7.25 Favored 'General case' 0 CA--C 1.51 -0.564 0 O-C-N 126.303 2.252 . . . . 1.46 110.716 168.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -55.71 -33.69 64.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 111.12 -2.764 . . . . 3.98 114.317 -174.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.581 ' OD2' ' ND2' ' A' ' 97' ' ' ASN . 22.8 p-10 -90.11 -17.89 26.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 112.781 -2.008 . . . . 3.1 113.231 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.97 23.46 77.02 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 117.701 -2.19 . . . . 0.46 111.939 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.581 ' ND2' ' OD2' ' A' ' 95' ' ' ASP . 40.0 p30 -63.92 -9.74 17.12 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 115.469 1.655 . . . . 1.31 115.469 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.19 -26.69 6.68 Favored Glycine 0 C--N 1.348 1.239 0 N-CA-C 116.413 1.325 . . . . 0.23 116.413 -171.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -110.56 145.19 38.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 123.351 1.548 . . . . 20.0 111.845 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.435 HD11 ' CE1' ' A' ' 89' ' ' PHE . 27.6 mm -105.43 131.53 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 112.482 -2.145 . . . . 0.31 110.068 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -101.75 162.21 13.07 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 113.982 -3.087 . . . . 0.21 109.762 170.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.514 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -49.26 -42.91 42.3 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 127.453 3.502 . . . . 0.11 112.246 173.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.97 -37.22 68.75 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 111.891 -2.413 . . . . 0.12 114.641 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.455 ' O ' HG13 ' A' ' 108' ' ' VAL . 2.5 tt0 -74.74 -29.26 61.1 Favored 'General case' 0 CA--C 1.495 -1.173 0 CA-C-N 113.638 -1.619 . . . . 0.81 114.146 174.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.673 HD21 ' HE1' ' A' ' 144' ' ' MET . 0.2 OUTLIER -53.88 -52.62 59.88 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 117.283 -1.767 . . . . 0.16 109.398 170.559 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.431 ' HE ' HG21 ' A' ' 121' ' ' VAL . 22.7 ttp85 -52.91 -32.64 46.42 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 115.255 1.576 . . . . 3.52 115.255 173.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -59.29 -54.15 50.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 116.769 -1.973 . . . . 0.49 112.805 170.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' HD23 ' A' ' 112' ' ' LEU . 0.9 OUTLIER -55.45 -35.3 37.04 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 125.33 1.644 . . . . 0.1 111.54 176.549 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.517 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 35.8 mmm -64.01 -41.71 97.37 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 123.461 1.601 . . . . 0.12 113.161 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.409 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 85.3 m -57.1 -43.34 82.15 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 113.617 -1.629 . . . . 0.18 112.872 171.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -60.72 -38.85 86.45 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 123.821 1.772 . . . . 1.12 113.207 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 108' ' ' VAL . 3.2 mm? -68.46 -8.24 39.09 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 112.402 -2.181 . . . . 0.45 112.254 179.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.43 -40.24 2.53 Favored Glycine 0 C--N 1.342 0.906 0 C-N-CA 118.229 -1.939 . . . . 0.41 110.854 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.517 ' O ' ' HB3' ' A' ' 109' ' ' MET . 20.0 mm-40 -97.6 117.71 32.49 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-N 112.451 -1.874 . . . . 2.29 111.524 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 48.3 mtpt -109.96 116.03 30.87 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 117.62 -1.632 . . . . 1.51 110.657 -176.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.6 mp -95.84 152.51 18.43 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 116.098 -2.241 . . . . 3.77 109.187 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.504 ' O ' HG23 ' A' ' 121' ' ' VAL . 81.2 p -74.76 175.91 7.52 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 117.764 -1.574 . . . . 0.3 112.641 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.46 ' O ' ' HB ' ' A' ' 121' ' ' VAL . 56.0 m-20 -50.82 -37.8 45.02 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.017 1.488 . . . . 1.6 115.017 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -54.62 -48.7 71.91 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-O 124.536 2.112 . . . . 1.75 112.54 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.418 ' O ' ' SD ' ' A' ' 124' ' ' MET . 6.4 mm-40 -70.16 -39.05 75.54 Favored 'General case' 0 C--O 1.206 -1.21 0 CA-C-N 110.629 -2.987 . . . . 0.68 111.073 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.599 ' O ' ' HB2' ' A' ' 124' ' ' MET . 80.1 t -51.82 -35.24 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 124.13 1.919 . . . . 0.44 114.556 173.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.84 -44.37 90.01 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.073 -2.251 . . . . 1.29 112.818 169.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -56.92 -28.07 61.6 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 118.475 -1.29 . . . . 3.19 114.149 168.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.599 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -62.63 -42.36 99.55 Favored 'General case' 0 CA--C 1.484 -1.588 0 CA-C-O 117.34 -1.314 . . . . 1.81 111.023 172.639 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.461 ' CG1' ' HB2' ' A' ' 102' ' ' ALA . 17.1 mt -53.92 -46.23 64.27 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.583 0 C-N-CA 116.879 -1.929 . . . . 0.09 110.217 170.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -57.39 13.24 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 115.496 -2.482 . . . . 4.42 116.032 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -65.31 -27.5 68.65 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 124.835 2.255 . . . . 1.95 113.602 -176.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -90.45 -25.99 20.06 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 112.399 -2.182 . . . . 0.11 114.402 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -89.59 90.83 8.43 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 126.814 2.571 . . . . 1.93 111.333 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.6 mp -94.66 -33.74 5.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 122.645 1.212 . . . . 0.45 113.293 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.0 p30 -66.36 -32.6 74.09 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 113.243 -1.798 . . . . 1.15 113.012 174.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.56 65.06 2.14 Favored Glycine 0 C--N 1.345 1.038 0 C-N-CA 116.868 -2.587 . . . . 1.15 113.677 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -119.94 -11.02 9.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 113.253 -1.473 . . . . 2.49 113.68 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.38 19.78 51.14 Favored Glycine 0 C--N 1.354 1.534 0 N-CA-C 116.549 1.38 . . . . 0.31 116.549 -174.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -154.13 162.9 40.88 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.007 1.723 . . . . 1.71 107.81 -173.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.437 HG13 ' HB1' ' A' ' 128' ' ' ALA . 97.3 t -113.96 119.85 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.676 0 C-N-CA 115.251 -2.579 . . . . 0.35 107.218 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -106.71 179.97 4.11 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 114.111 -3.036 . . . . 2.45 114.293 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -68.41 -33.86 74.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 124.185 1.945 . . . . 20.0 114.353 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -61.66 -47.63 84.5 Favored 'General case' 0 CA--C 1.492 -1.282 0 CA-C-N 110.634 -2.985 . . . . 2.9 110.162 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.549 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 80.8 mt-10 -63.38 -30.78 71.85 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-N 111.308 -2.678 . . . . 2.77 114.178 172.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -56.62 -39.21 73.22 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 124.285 1.993 . . . . 0.38 112.458 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.38 -47.63 76.73 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 CA-C-N 111.995 -2.366 . . . . 0.4 111.908 170.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.9 -26.61 67.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.903 1.446 . . . . 1.57 114.903 -177.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.673 ' HE1' HD21 ' A' ' 105' ' ' LEU . 4.7 ttm -74.42 -53.46 9.52 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 124.958 2.314 . . . . 0.79 110.587 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 28.1 mtt -76.66 -50.84 12.74 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 115.823 -2.351 . . . . 0.36 114.143 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.0 m -60.78 -56.53 20.16 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 112.937 -1.938 . . . . 0.82 112.37 176.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.25 -167.21 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 O-C-N 124.842 1.339 . . . . 1.28 112.101 -177.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 10.2 tptt . . . . . 0 C--N 1.346 0.431 0 CA-C-O 118.175 -0.917 . . . . 20.0 112.12 -179.41 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 CA--C 1.496 -1.102 0 CA-C-O 117.785 -1.102 . . . . 1.97 108.132 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.59 -33.03 74.97 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 125.743 1.902 . . . . 2.22 114.118 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.2 mm-40 -53.59 -56.9 13.19 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 126.24 2.924 . . . . 2.28 112.182 -178.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.7 pt -72.16 -50.33 37.34 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 CA-C-N 111.256 -2.702 . . . . 0.3 114.207 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -73.55 -56.67 4.72 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.053 -1.43 . . . . 2.72 113.897 -174.302 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.02 -37.29 81.22 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 113.846 -1.525 . . . . 3.05 113.851 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.67 -38.32 89.86 Favored 'General case' 0 C--O 1.213 -0.831 0 C-N-CA 113.277 -3.369 . . . . 0.07 109.702 169.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.8 t80 -56.91 -29.76 63.33 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 115.643 1.72 . . . . 0.11 115.643 168.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -67.81 -39.49 83.95 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 117.344 -1.742 . . . . 4.69 112.035 176.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.75 -32.82 58.32 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 114.057 -1.429 . . . . 0.11 111.991 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.597 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -60.52 -49.25 78.32 Favored 'General case' 0 CA--C 1.497 -1.078 0 O-C-N 125.745 1.903 . . . . 0.21 111.635 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -78.99 80.28 5.34 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.325 2.012 . . . . 1.46 109.681 169.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -56.82 -30.56 63.87 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 111.409 -2.632 . . . . 3.98 113.568 -171.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.559 ' OD2' ' ND2' ' A' ' 97' ' ' ASN . 13.5 p30 -90.43 -18.33 25.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 113.095 -1.866 . . . . 3.1 113.896 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.17 15.89 76.81 Favored Glycine 0 C--N 1.343 0.927 0 C-N-CA 116.802 -2.618 . . . . 0.46 113.103 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.559 ' ND2' ' OD2' ' A' ' 95' ' ' ASP . 41.4 p30 -64.92 -10.5 29.37 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.011 1.856 . . . . 1.31 116.011 -177.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.59 -29.07 7.0 Favored Glycine 0 C--N 1.347 1.178 0 N-CA-C 116.113 1.205 . . . . 0.23 116.113 -172.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -110.07 146.35 35.54 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 113.581 -1.309 . . . . 20.0 111.696 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 37.9 mm -109.26 130.47 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 CA-C-N 112.641 -2.072 . . . . 0.31 110.881 -179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 t -101.43 163.21 12.39 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 114.486 -2.885 . . . . 0.21 108.955 171.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.467 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -50.43 -42.5 54.08 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 127.825 3.678 . . . . 0.11 112.11 176.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -53.58 -37.7 63.21 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.604 -2.544 . . . . 0.12 114.778 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.533 ' O ' HG13 ' A' ' 108' ' ' VAL . 1.7 mt-10 -74.69 -30.52 61.59 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 115.512 1.671 . . . . 0.81 115.512 172.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.646 HD12 ' HG3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -55.65 -35.85 66.4 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 115.825 -2.35 . . . . 0.16 111.673 170.433 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.401 ' NH1' ' OD1' ' A' ' 118' ' ' ASP . 64.4 ttt180 -67.83 -30.47 69.88 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 113.957 -1.474 . . . . 3.52 113.913 172.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.408 ' O ' ' HB ' ' A' ' 110' ' ' THR . 11.8 t-80 -62.32 -50.3 72.18 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 116.979 -1.888 . . . . 0.49 111.142 171.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.569 HG12 ' HB3' ' A' ' 92' ' ' PHE . 0.9 OUTLIER -55.42 -40.59 58.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 CA-C-N 113.623 -1.626 . . . . 0.1 110.687 177.756 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.512 ' SD ' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -60.41 -39.71 88.37 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 125.633 2.635 . . . . 0.12 113.466 174.423 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 107' ' ' HIS . 19.9 m -53.83 -47.99 70.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 112.871 -1.968 . . . . 0.18 113.413 171.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -61.91 -37.23 83.86 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 126.559 2.412 . . . . 1.12 112.96 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.9 mm? -63.55 -11.59 25.68 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 113.874 -1.512 . . . . 0.45 111.781 176.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.05 -34.83 4.94 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 118.637 -1.744 . . . . 0.41 110.36 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 109' ' ' MET . 23.7 mt-10 -108.23 108.45 19.49 Favored 'General case' 0 C--O 1.215 -0.741 0 CA-C-N 112.888 -1.656 . . . . 2.29 109.093 -173.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -89.34 135.52 33.54 Favored 'General case' 0 CA--C 1.498 -1.026 0 C-N-CA 116.44 -2.104 . . . . 1.51 110.895 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.512 HD23 ' SD ' ' A' ' 109' ' ' MET . 1.3 mm? -101.4 155.67 17.92 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 126.534 2.396 . . . . 3.77 109.582 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.533 ' O ' HG23 ' A' ' 121' ' ' VAL . 74.0 p -78.14 170.25 16.92 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 116.592 -2.043 . . . . 0.3 112.044 -173.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.401 ' OD1' ' NH1' ' A' ' 106' ' ' ARG . 50.1 m-20 -55.04 -31.72 61.31 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 114.662 1.356 . . . . 1.6 114.662 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.42 -48.42 81.72 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 125.268 2.461 . . . . 1.75 112.018 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.486 ' O ' ' SD ' ' A' ' 124' ' ' MET . 48.5 mm-40 -67.01 -39.06 86.98 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 109.543 -3.48 . . . . 0.68 111.472 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.642 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.1 t -53.34 -33.87 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 124.371 2.034 . . . . 0.44 114.021 174.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -68.54 -41.81 79.31 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 115.938 -2.305 . . . . 1.29 112.921 170.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -56.96 -26.76 60.39 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 118.092 -1.443 . . . . 3.19 114.385 167.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.646 ' HG3' HD12 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.21 -40.51 96.2 Favored 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 115.371 -0.831 . . . . 1.81 111.003 173.847 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 102' ' ' ALA . 22.0 mt -53.51 -48.5 58.14 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.439 0 C-N-CA 116.036 -2.266 . . . . 0.09 110.08 168.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -54.53 45.66 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 116.668 2.099 . . . . 4.42 116.668 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.4 -28.06 68.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 123.478 1.609 . . . . 1.95 112.611 -176.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -92.28 -25.4 18.61 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 113.161 -1.836 . . . . 0.11 115.047 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -89.4 92.44 9.14 Favored 'General case' 0 C--N 1.338 0.085 0 O-C-N 126.729 2.518 . . . . 1.93 111.181 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.22 -32.26 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 123.125 1.441 . . . . 0.45 113.354 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -69.08 -30.96 69.39 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 112.832 -1.985 . . . . 1.15 113.632 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.14 63.46 2.66 Favored Glycine 0 C--N 1.345 1.065 0 C-N-CA 117.389 -2.339 . . . . 1.15 114.173 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -118.54 -12.17 9.82 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 113.294 -1.453 . . . . 2.49 113.586 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.17 22.3 38.61 Favored Glycine 0 C--N 1.35 1.347 0 N-CA-C 116.635 1.414 . . . . 0.31 116.635 -175.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -155.98 163.93 39.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.775 1.63 . . . . 1.71 108.267 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 128' ' ' ALA . 90.2 t -115.26 119.36 61.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 116.316 -2.153 . . . . 0.35 108.277 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -105.29 173.76 6.17 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 115.959 -2.297 . . . . 2.45 114.142 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -64.77 -36.56 84.71 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 124.274 1.988 . . . . 20.0 114.276 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.96 -45.5 94.48 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 111.351 -2.659 . . . . 2.9 110.51 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.502 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 64.4 mt-10 -64.63 -31.63 72.94 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-N 110.5 -3.046 . . . . 2.77 114.445 172.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 145' ' ' MET . 9.1 t80 -56.88 -40.7 76.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.953 1.835 . . . . 0.38 111.445 173.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.87 -46.45 88.54 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 CA-C-N 112.802 -1.999 . . . . 0.4 112.326 170.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -57.71 -33.97 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 114.333 1.234 . . . . 1.57 114.333 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.509 ' HE1' HD21 ' A' ' 105' ' ' LEU . 14.9 ttp -76.95 -48.04 19.22 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 123.796 1.76 . . . . 0.79 111.673 -178.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 141' ' ' PHE . 17.5 mmt -72.15 -56.86 4.86 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.53 -2.068 . . . . 0.36 112.452 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 17.4 m -60.31 -56.33 22.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 111.849 -2.432 . . . . 0.82 112.885 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 57.03 -163.63 0.17 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.396 -1.274 . . . . 1.28 112.031 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.344 0.333 0 CA-C-N 115.19 -0.914 . . . . 20.0 111.625 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 107.861 -1.162 . . . . 1.97 107.861 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HB2' ' HB3' ' A' ' 87' ' ' GLU . 2.1 pp20? -67.32 -33.44 75.26 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 126.223 2.202 . . . . 2.22 112.905 174.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.1 mm-40 -53.76 -54.18 41.76 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 125.231 2.443 . . . . 2.28 112.864 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.6 pt -73.38 -49.41 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 114.67 -2.812 . . . . 0.3 114.489 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -53.06 8.31 Favored 'General case' 0 C--O 1.206 -1.187 0 C-N-CA 118.327 -1.349 . . . . 2.72 113.892 -174.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HB3' ' HB2' ' A' ' 83' ' ' GLU . 16.6 tt0 -70.35 -35.53 73.63 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 114.654 1.353 . . . . 3.05 114.654 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -63.0 -39.22 94.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 113.434 -3.307 . . . . 0.07 109.981 166.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.598 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 84.8 t80 -56.17 -30.41 62.19 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.25 1.574 . . . . 0.11 115.25 169.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -37.64 77.92 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 115.683 -2.407 . . . . 4.69 110.553 176.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.1 t -65.1 -34.55 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 116.624 -2.03 . . . . 0.11 113.238 173.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.598 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.1 m-30 -61.23 -48.54 80.98 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 112.103 -2.317 . . . . 0.21 111.228 -178.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -76.42 76.61 3.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 125.034 2.35 . . . . 1.46 111.368 166.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -60.05 -30.09 68.97 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 111.213 -2.721 . . . . 3.98 115.314 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -85.4 -26.21 26.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 112.393 -2.185 . . . . 3.1 112.418 175.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.76 27.08 73.69 Favored Glycine 0 C--N 1.344 1.001 0 CA-C-N 113.223 -1.808 . . . . 0.46 111.685 178.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -68.19 -16.79 64.13 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 125.307 1.24 . . . . 1.31 114.188 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.67 -14.7 64.46 Favored Glycine 0 C--N 1.343 0.962 0 O-C-N 125.422 1.701 . . . . 0.23 113.743 -175.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -114.38 146.76 40.15 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.295 -1.453 . . . . 20.0 109.651 -173.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.9 mm -113.27 135.0 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.768 0 CA-C-N 112.669 -2.06 . . . . 0.31 110.078 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.0 t -107.4 159.72 16.18 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 116.242 -2.183 . . . . 0.21 108.511 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -46.19 -43.45 15.24 Favored 'General case' 0 CA--C 1.548 0.883 1 CA-C-O 128.513 4.006 . . . . 0.11 113.226 177.681 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -54.62 -46.83 73.95 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 110.717 -2.947 . . . . 0.12 115.201 174.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -28.15 69.73 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 115.356 1.613 . . . . 0.81 115.356 172.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.564 ' HG ' ' HB3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -54.64 -50.65 67.62 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 117.185 -1.806 . . . . 0.16 111.0 167.84 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -54.76 -28.52 49.21 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 117.358 -1.737 . . . . 3.52 115.256 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -62.86 -54.99 30.22 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 116.871 -1.932 . . . . 0.49 111.806 171.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.551 ' O ' HD23 ' A' ' 112' ' ' LEU . 2.7 m -57.68 -33.42 45.0 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 116.728 -1.989 . . . . 0.1 111.171 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.453 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 41.7 mmm -60.58 -44.52 96.11 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 123.292 1.52 . . . . 0.12 113.547 171.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.4 m -55.51 -45.18 77.14 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 113.62 -1.627 . . . . 0.18 112.384 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -59.24 -41.86 89.71 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 123.615 1.674 . . . . 1.12 112.826 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.551 HD23 ' O ' ' A' ' 108' ' ' VAL . 1.6 mm? -64.44 -7.5 10.15 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 112.688 -2.051 . . . . 0.45 112.363 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.8 -35.99 4.06 Favored Glycine 0 C--N 1.339 0.705 0 C-N-CA 117.835 -2.126 . . . . 0.41 110.796 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 109' ' ' MET . 33.2 mm-40 -108.5 111.07 22.75 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.574 -1.813 . . . . 2.29 110.645 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -93.32 130.12 39.18 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 113.932 -1.485 . . . . 1.51 111.056 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.463 ' HB3' ' CB ' ' A' ' 120' ' ' GLU . 4.4 mm? -95.02 153.16 17.77 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 116.375 -2.13 . . . . 3.77 109.82 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.536 ' O ' HG23 ' A' ' 121' ' ' VAL . 44.6 p -76.21 169.57 17.96 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 113.725 -1.579 . . . . 0.3 112.333 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -52.48 -33.92 46.83 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.702 1.371 . . . . 1.6 114.702 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -52.31 65.99 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 126.751 3.167 . . . . 1.75 111.125 176.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 124' ' ' MET . 12.2 mm-40 -61.73 -35.71 78.86 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 109.286 -3.597 . . . . 0.68 112.526 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.623 HG12 ' HB1' ' A' ' 102' ' ' ALA . 88.3 t -55.12 -36.33 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 123.5 1.619 . . . . 0.44 114.15 176.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.08 -44.9 78.88 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 112.415 -2.175 . . . . 1.29 111.628 172.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -57.4 -28.74 63.5 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 118.146 -1.421 . . . . 3.19 114.281 168.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.564 ' HB3' ' HG ' ' A' ' 105' ' ' LEU . 25.9 mmt -65.96 -37.03 84.94 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 115.253 -0.885 . . . . 1.81 110.709 178.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 14.3 mt -56.82 -50.23 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 116.151 -2.22 . . . . 0.09 109.736 168.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -37.73 73.79 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 116.029 1.863 . . . . 4.42 116.029 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -78.72 -32.1 46.71 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-O 124.709 2.195 . . . . 1.95 112.226 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -89.08 -26.6 21.29 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 112.705 -2.043 . . . . 0.11 114.092 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -86.53 91.27 8.5 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 126.612 2.445 . . . . 1.93 111.45 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.0 mp -95.5 -32.94 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-N 114.019 -1.446 . . . . 0.45 112.791 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -67.83 -33.44 74.78 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 113.253 -1.794 . . . . 1.15 113.73 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.09 64.57 2.28 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 118.179 -1.962 . . . . 1.15 113.419 -176.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -119.48 -10.95 9.56 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 113.705 -1.248 . . . . 2.49 113.595 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.39 22.72 39.57 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 116.616 1.406 . . . . 0.31 116.616 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -156.3 164.87 37.8 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.084 1.354 . . . . 1.71 107.668 -174.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.473 HG13 ' HB1' ' A' ' 128' ' ' ALA . 94.3 t -115.54 119.54 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 115.84 -2.344 . . . . 0.35 107.133 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -104.78 175.14 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 116.001 -2.28 . . . . 2.45 114.969 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.68 -35.2 80.27 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 123.279 1.514 . . . . 20.0 113.899 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -62.94 -46.75 86.28 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 111.962 -2.381 . . . . 2.9 110.466 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 60.8 mt-10 -60.44 -31.07 70.07 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 110.394 -3.094 . . . . 2.77 114.854 171.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.96 -41.16 74.3 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 124.204 1.955 . . . . 0.38 112.195 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.7 t -69.13 -49.69 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 112.239 -2.255 . . . . 0.4 112.109 171.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.414 ' HB3' ' HA ' ' A' ' 140' ' ' GLU . 12.5 tp60 -56.06 -27.35 53.04 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 114.205 -1.362 . . . . 1.57 114.671 -178.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -53.3 8.66 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 124.155 1.931 . . . . 0.79 110.899 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 33.0 mtt -76.47 -54.29 6.93 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 114.614 -2.834 . . . . 0.36 114.731 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 23.3 m -57.08 -59.74 4.63 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.345 -1.752 . . . . 0.82 112.686 173.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 52.66 -159.09 0.13 Allowed 'General case' 0 C--N 1.345 0.376 0 O-C-N 124.884 1.365 . . . . 1.28 111.47 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt . . . . . 0 C--N 1.347 0.49 0 CA-C-O 118.462 -0.78 . . . . 20.0 111.052 175.074 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 . . . . . 0 CA--C 1.502 -0.897 0 N-CA-C 106.95 -1.5 . . . . 1.97 106.95 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -37.13 47.88 Favored 'General case' 0 C--O 1.218 -0.571 0 O-C-N 125.895 1.997 . . . . 2.22 114.013 168.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -50.63 -59.74 3.75 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 123.943 1.83 . . . . 2.28 111.778 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.9 pt -73.02 -49.25 40.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 116.242 -2.183 . . . . 0.3 115.481 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.43 -55.05 7.66 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 113.269 -1.787 . . . . 2.72 113.948 -175.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -70.12 -35.27 73.99 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 117.9 -1.52 . . . . 3.05 113.807 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.69 92.9 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 113.974 -3.091 . . . . 0.07 109.305 170.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.55 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 76.4 t80 -56.45 -32.09 64.6 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 114.998 1.481 . . . . 0.11 114.998 168.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -65.96 -36.88 84.54 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 115.6 -2.44 . . . . 4.69 113.521 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.1 t -70.26 -28.41 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 117.809 -1.556 . . . . 0.11 113.058 171.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.55 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.8 m-30 -63.03 -49.98 72.5 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 113.067 -1.879 . . . . 0.21 111.571 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -76.5 79.32 3.2 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 126.959 2.662 . . . . 1.46 109.796 167.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -58.19 -30.46 66.47 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 111.435 -2.621 . . . . 3.98 113.879 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.574 ' OD2' ' ND2' ' A' ' 97' ' ' ASN . 21.3 p-10 -91.48 -17.39 25.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 113.525 -1.671 . . . . 3.1 113.756 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.66 20.47 79.63 Favored Glycine 0 C--N 1.343 0.931 0 C-N-CA 117.486 -2.292 . . . . 0.46 112.828 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.574 ' ND2' ' OD2' ' A' ' 95' ' ' ASP . 40.4 p30 -63.66 -9.22 12.78 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 116.321 1.971 . . . . 1.31 116.321 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.18 -31.3 5.75 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 124.821 1.326 . . . . 0.23 115.056 -171.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -110.81 145.87 37.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 112.806 -1.697 . . . . 20.0 112.651 -172.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' A' ' 104' ' ' GLU . 13.6 mm -102.88 133.84 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-N 112.146 -2.297 . . . . 0.31 110.01 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.9 t -107.23 159.12 16.59 Favored 'General case' 0 CA--C 1.503 -0.832 0 C-N-CA 115.197 -2.601 . . . . 0.21 108.017 170.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.445 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -47.53 -42.47 23.39 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 127.927 3.727 . . . . 0.11 112.141 178.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.07 87.42 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-N 111.593 -2.549 . . . . 0.12 115.174 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.579 ' OE1' HD13 ' A' ' 100' ' ' ILE . 4.4 tt0 -66.26 -25.46 66.89 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 114.986 1.476 . . . . 0.81 114.986 171.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.648 HD13 HG22 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -56.33 -45.83 80.16 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 116.293 -2.163 . . . . 0.16 111.306 167.298 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 -55.8 -28.22 55.11 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.176 1.941 . . . . 3.52 115.327 171.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.401 ' O ' ' HB ' ' A' ' 110' ' ' THR . 55.7 t60 -65.1 -52.2 56.86 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 116.313 -2.155 . . . . 0.49 112.008 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.648 HG22 HD13 ' A' ' 105' ' ' LEU . 1.2 m -55.65 -36.68 43.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.834 0 C-N-CA 116.233 -2.187 . . . . 0.1 111.612 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.51 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 50.0 mmm -60.24 -44.54 95.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 125.211 2.434 . . . . 0.12 113.581 173.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 107' ' ' HIS . 80.8 m -51.1 -47.01 62.02 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 112.815 -1.993 . . . . 0.18 113.053 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.41 -39.24 90.05 Favored 'General case' 0 C--O 1.216 -0.661 0 O-C-N 125.837 1.96 . . . . 1.12 113.443 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.481 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.6 mm? -67.08 -7.96 26.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 123.38 1.562 . . . . 0.45 112.274 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 97.78 -37.92 3.29 Favored Glycine 0 C--N 1.342 0.865 0 C-N-CA 118.514 -1.803 . . . . 0.41 110.8 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.51 ' O ' ' HB3' ' A' ' 109' ' ' MET . 74.4 mm-40 -105.79 116.12 31.4 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-N 112.196 -2.002 . . . . 2.29 109.363 -173.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -94.41 128.91 41.25 Favored 'General case' 0 CA--C 1.502 -0.89 0 C-N-CA 115.718 -2.393 . . . . 1.51 111.239 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' A' ' 124' ' ' MET . 39.3 mt -93.2 157.89 16.04 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 116.193 -2.203 . . . . 3.77 109.949 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.6 p -81.02 175.09 10.99 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 117.312 -1.755 . . . . 0.3 111.406 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -58.44 -29.97 66.55 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 114.725 1.38 . . . . 1.6 114.725 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.72 -50.98 71.73 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-O 124.991 2.329 . . . . 1.75 111.095 175.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.48 ' O ' ' SD ' ' A' ' 124' ' ' MET . 17.6 mm-40 -63.51 -43.23 97.82 Favored 'General case' 0 C--O 1.207 -1.174 0 CA-C-N 109.716 -3.402 . . . . 0.68 110.693 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.604 ' O ' ' HB2' ' A' ' 124' ' ' MET . 72.6 t -51.51 -34.7 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 124.468 2.08 . . . . 0.44 115.022 174.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -65.35 -45.6 83.54 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 116.402 -2.119 . . . . 1.29 112.021 170.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -56.06 -29.09 60.0 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.262 -1.375 . . . . 3.19 114.008 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.604 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -63.07 -39.35 94.45 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 112.06 0.393 . . . . 1.81 112.06 174.399 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 24.2 mt -53.91 -48.95 62.32 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.573 0 C-N-CA 115.6 -2.44 . . . . 0.09 109.636 169.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -57.23 13.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 117.949 2.574 . . . . 4.42 117.949 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.92 -29.15 70.07 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.97 1.366 . . . . 1.95 112.191 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.542 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -91.2 -23.86 20.09 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 113.411 -1.722 . . . . 0.11 115.176 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -90.58 92.5 8.88 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 126.092 2.12 . . . . 1.93 111.743 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.443 HG21 ' HG2' ' A' ' 143' ' ' GLN . 3.8 mp -94.08 -34.32 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 123.355 1.55 . . . . 0.45 113.441 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -67.6 -31.61 71.77 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 113.448 -1.705 . . . . 1.15 113.291 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.47 64.71 2.32 Favored Glycine 0 C--N 1.343 0.921 0 C-N-CA 117.583 -2.246 . . . . 1.15 114.101 -176.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -119.7 -10.39 9.58 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 125.259 1.211 . . . . 2.49 113.731 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 21.52 47.07 Favored Glycine 0 C--N 1.354 1.547 0 N-CA-C 116.962 1.545 . . . . 0.31 116.962 -174.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -155.22 164.25 39.07 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.04 1.736 . . . . 1.71 108.564 -175.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.542 HG13 ' HB1' ' A' ' 128' ' ' ALA . 97.4 t -115.31 121.68 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 C-N-CA 116.629 -2.029 . . . . 0.35 107.883 -178.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -109.26 173.88 6.12 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 115.26 -2.576 . . . . 2.45 114.477 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -64.63 -35.38 80.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 123.998 1.856 . . . . 20.0 114.441 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -62.78 -44.68 95.53 Favored 'General case' 0 CA--C 1.492 -1.273 0 CA-C-N 111.69 -2.504 . . . . 2.9 110.311 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.512 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 70.3 mt-10 -62.66 -30.65 71.54 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 110.971 -2.831 . . . . 2.77 114.023 172.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -58.02 -37.53 74.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 124.494 2.093 . . . . 0.38 112.749 171.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.99 -49.71 54.08 Favored 'Isoleucine or valine' 0 C--N 1.345 0.397 0 CA-C-N 112.277 -2.238 . . . . 0.4 112.363 169.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.443 ' HG2' HG21 ' A' ' 130' ' ' ILE . 0.4 OUTLIER -58.06 -26.71 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.616 1.339 . . . . 1.57 114.616 -177.209 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.0 ttp -77.11 -49.74 14.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 122.993 1.377 . . . . 0.79 111.657 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 mtt -77.22 -52.4 9.29 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 115.883 -2.327 . . . . 0.36 114.627 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.3 m -57.72 -53.38 58.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 113.117 -1.856 . . . . 0.82 112.736 174.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.62 -168.7 0.1 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 125.342 1.651 . . . . 1.28 111.911 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? . . . . . 0 C--N 1.348 0.519 0 CA-C-N 115.498 -0.774 . . . . 20.0 112.138 -177.517 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 CA--C 1.48 -1.744 0 CA-C-O 119.614 -0.232 . . . . 1.97 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -65.22 -35.69 81.84 Favored 'General case' 0 C--O 1.217 -0.655 0 O-C-N 126.337 2.273 . . . . 2.22 112.268 171.417 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 5.8 mm-40 -53.83 -55.33 27.62 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 126.056 2.836 . . . . 2.28 112.295 -176.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.4 pt -72.21 -52.18 25.81 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 111.214 -2.721 . . . . 0.3 114.288 175.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -75.19 -54.99 6.18 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 117.301 -1.76 . . . . 2.72 114.206 -174.672 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 83' ' ' GLU . 21.1 tt0 -67.11 -34.69 78.14 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 117.962 -1.495 . . . . 3.05 114.882 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.7 -40.83 98.35 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 112.781 -3.568 . . . . 0.07 109.918 168.201 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.622 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 83.2 t80 -53.95 -31.55 50.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.744 1.757 . . . . 0.11 115.744 168.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -67.75 -36.93 81.43 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 117.651 -1.62 . . . . 4.69 112.618 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.57 -33.21 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 118.004 -1.478 . . . . 0.11 112.618 170.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.622 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.3 m-30 -59.95 -49.92 75.78 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 112.731 -2.031 . . . . 0.21 110.99 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -78.27 78.17 4.75 Favored 'General case' 0 CA--C 1.509 -0.619 0 O-C-N 125.813 1.946 . . . . 1.46 110.203 170.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -57.76 -29.68 65.01 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 112.361 -2.2 . . . . 3.98 114.605 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.569 ' OD2' ' ND2' ' A' ' 97' ' ' ASN . 19.9 p30 -89.15 -18.06 27.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 112.646 -2.07 . . . . 3.1 114.229 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 71.68 17.43 76.59 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 117.575 -2.25 . . . . 0.46 112.849 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.569 ' ND2' ' OD2' ' A' ' 95' ' ' ASP . 41.8 p30 -65.28 -8.86 19.86 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 115.813 1.783 . . . . 1.31 115.813 -177.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.74 -29.32 5.89 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 116.121 1.209 . . . . 0.23 116.121 -173.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -110.43 146.79 35.27 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 113.4 -1.4 . . . . 20.0 111.79 -175.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.403 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 32.4 mm -114.95 132.18 64.95 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 CA-C-N 112.225 -2.261 . . . . 0.31 110.231 -177.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -103.78 167.99 9.43 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 113.856 -3.137 . . . . 0.21 110.907 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.751 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -48.63 -42.65 34.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 127.528 3.537 . . . . 0.11 113.225 175.136 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -51.84 -41.7 62.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.572 -2.558 . . . . 0.12 115.284 174.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.546 ' O ' HG13 ' A' ' 108' ' ' VAL . 2.5 mt-10 -76.8 -28.79 55.74 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 113.618 -1.628 . . . . 0.81 114.927 173.263 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.575 HD23 HG11 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -56.05 -29.03 59.87 Favored 'General case' 0 C--O 1.221 -0.419 0 O-C-N 124.91 1.381 . . . . 0.16 111.956 168.669 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.95 ' NH2' ' OD1' ' A' ' 118' ' ' ASP . 35.1 ttm-85 -74.25 -34.24 63.55 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 114.296 -1.32 . . . . 3.52 113.244 171.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.497 ' O ' ' HB ' ' A' ' 110' ' ' THR . 12.3 t-160 -61.37 -46.47 90.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 116.421 -2.112 . . . . 0.49 111.006 172.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 105' ' ' LEU . 1.1 m -59.19 -38.52 74.81 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 113.74 -1.573 . . . . 0.1 110.814 175.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.495 ' SD ' ' HG ' ' A' ' 116' ' ' LEU . 2.0 mmt -58.18 -40.5 81.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 124.616 2.151 . . . . 0.12 114.493 173.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.54 HG23 ' HE3' ' A' ' 115' ' ' LYS . 52.8 m -52.98 -47.44 68.2 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 113.056 -1.884 . . . . 0.18 112.733 171.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -62.08 -38.01 87.18 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 126.958 2.661 . . . . 1.12 114.028 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.73 -14.46 52.58 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 113.355 -1.748 . . . . 0.45 111.937 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.11 -36.95 3.91 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 118.176 -1.964 . . . . 0.41 110.825 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 109' ' ' MET . 1.4 mt-10 -106.65 110.12 22.22 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 112.717 -1.741 . . . . 2.29 109.377 -173.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.54 ' HE3' HG23 ' A' ' 110' ' ' THR . 33.8 mttp -94.44 119.95 33.93 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 116.153 -2.219 . . . . 1.51 110.036 177.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.495 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 14.0 mt -95.53 161.0 14.24 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 114.424 -2.91 . . . . 3.77 109.893 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.5 p -76.39 176.98 7.7 Favored 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 117.378 -1.729 . . . . 0.3 111.751 -174.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.95 ' OD1' ' NH2' ' A' ' 106' ' ' ARG . 1.5 m-20 -50.8 -39.19 52.19 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 115.061 1.504 . . . . 1.6 115.061 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.76 -54.05 39.38 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-O 125.928 2.775 . . . . 1.75 110.493 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.68 -33.83 76.52 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 109.724 -3.398 . . . . 0.68 113.343 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.751 HG12 ' HB1' ' A' ' 102' ' ' ALA . 94.3 t -56.09 -35.67 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 123.517 1.627 . . . . 0.44 114.694 171.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -64.3 -44.22 92.31 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 112.306 -2.225 . . . . 1.29 111.804 170.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.68 -29.3 66.52 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 117.317 -1.753 . . . . 3.19 114.077 168.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.441 ' SD ' ' HA ' ' A' ' 121' ' ' VAL . 39.4 mtt -68.76 -32.27 71.9 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 117.857 -1.068 . . . . 1.81 112.176 176.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 102' ' ' ALA . 37.8 mt -55.99 -51.02 65.98 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 117.132 -1.827 . . . . 0.09 108.666 166.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.593 ' C ' HH11 ' A' ' 126' ' ' ARG . 0.0 OUTLIER -54.6 -60.78 2.88 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 116.653 -2.019 . . . . 4.42 113.825 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.42 ' HA ' ' NH1' ' A' ' 126' ' ' ARG . 6.7 tp10 -61.76 -25.71 67.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.482 2.087 . . . . 1.95 113.726 -174.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.535 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -91.54 -23.19 20.0 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 113.001 -1.909 . . . . 0.11 115.381 176.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -92.27 93.39 8.63 Favored 'General case' 0 CA--C 1.523 -0.09 0 O-C-N 126.12 2.138 . . . . 1.93 110.096 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.3 mp -95.66 -34.47 5.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 114.392 -1.276 . . . . 0.45 113.245 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -66.64 -31.15 71.66 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 113.185 -1.825 . . . . 1.15 113.3 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.45 64.75 2.41 Favored Glycine 0 C--N 1.344 0.982 0 C-N-CA 117.996 -2.049 . . . . 1.15 113.6 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 p-10 -118.44 -12.2 9.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.254 -0.973 . . . . 2.49 113.611 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.83 19.27 48.34 Favored Glycine 0 C--N 1.355 1.614 0 N-CA-C 117.018 1.567 . . . . 0.31 117.018 -174.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -152.7 165.09 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.864 1.666 . . . . 1.71 108.477 -175.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.575 HG11 HD23 ' A' ' 105' ' ' LEU . 84.4 t -114.43 122.0 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 O-C-N 126.181 2.176 . . . . 0.35 108.349 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -109.59 174.51 5.83 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 114.239 -2.985 . . . . 2.45 112.581 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.433 ' HD2' ' OE2' ' A' ' 139' ' ' GLU . 34.3 t80 -65.51 -36.9 85.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.425 1.583 . . . . 20.0 113.875 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.433 ' OE2' ' HD2' ' A' ' 138' ' ' TYR . 12.7 mm-40 -62.56 -46.07 90.03 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 111.83 -2.441 . . . . 2.9 109.94 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.534 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 71.3 mt-10 -63.21 -30.64 71.74 Favored 'General case' 0 CA--C 1.501 -0.921 0 CA-C-N 111.252 -2.704 . . . . 2.77 114.468 172.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.55 ' O ' ' HG3' ' A' ' 145' ' ' MET . 10.0 t80 -58.68 -38.07 77.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 124.195 1.95 . . . . 0.38 111.954 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 139' ' ' GLU . 86.8 t -69.32 -47.55 72.72 Favored 'Isoleucine or valine' 0 C--N 1.344 0.365 0 CA-C-N 112.928 -1.942 . . . . 0.4 111.182 171.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.21 -30.53 64.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.522 1.304 . . . . 1.57 114.522 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.1 ttp -77.78 -46.52 21.4 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 123.792 1.758 . . . . 0.79 111.379 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 141' ' ' PHE . 2.0 mtt -76.83 -52.34 9.68 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 115.833 -2.347 . . . . 0.36 113.467 -179.063 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.5 m -58.79 -52.04 67.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 112.274 -2.239 . . . . 0.82 112.834 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.68 -162.41 0.18 Allowed 'General case' 0 C--O 1.233 0.223 0 O-C-N 125.064 1.477 . . . . 1.28 111.128 -178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 12.5 tptt . . . . . 0 C--N 1.344 0.345 0 CA-C-O 118.334 -0.841 . . . . 20.0 111.51 179.827 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 . . . . . 0 CA--C 1.492 -1.271 0 N-CA-C 108.237 -1.023 . . . . 1.97 108.237 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -65.73 -33.59 76.24 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 125.909 2.006 . . . . 2.22 113.957 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 48.8 mm-40 -52.75 -55.82 20.05 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-O 125.955 2.788 . . . . 2.28 112.068 -178.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 pt -73.92 -48.73 37.65 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 CA-C-N 111.272 -2.695 . . . . 0.3 114.461 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -76.46 -55.57 5.42 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 117.764 -1.574 . . . . 2.72 113.894 -174.731 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -63.91 -41.1 97.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.149 -1.387 . . . . 3.05 112.862 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.42 -37.97 87.89 Favored 'General case' 0 C--O 1.213 -0.866 0 C-N-CA 113.009 -3.477 . . . . 0.07 110.04 172.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.588 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.7 t80 -54.71 -30.32 55.63 Favored 'General case' 0 C--N 1.349 0.567 0 N-CA-C 116.053 1.871 . . . . 0.11 116.053 167.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -67.88 -39.69 83.64 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 117.585 -1.646 . . . . 4.69 111.894 174.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 27.4 t -67.71 -29.88 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 118.192 -1.403 . . . . 0.11 112.926 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.588 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -63.03 -50.92 68.78 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 113.372 -1.74 . . . . 0.21 110.358 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -80.58 79.09 7.25 Favored 'General case' 0 CA--C 1.51 -0.564 0 O-C-N 126.303 2.252 . . . . 1.46 110.716 168.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -55.71 -33.69 64.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 111.12 -2.764 . . . . 3.98 114.317 -174.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.427 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 22.8 p-10 -90.11 -17.89 26.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 112.781 -2.008 . . . . 3.1 113.231 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.97 23.46 77.02 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 117.701 -2.19 . . . . 0.46 111.939 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.469 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.92 -9.74 17.12 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 115.469 1.655 . . . . 1.31 115.469 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.469 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 87.19 -26.69 6.68 Favored Glycine 0 C--N 1.348 1.239 0 N-CA-C 116.413 1.325 . . . . 0.23 116.413 -171.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.427 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 41.9 m-85 -110.56 145.19 38.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 123.351 1.548 . . . . 20.0 111.845 -176.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.435 HD11 ' CE1' ' A' ' 89' ' ' PHE . 27.6 mm -105.43 131.53 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 112.482 -2.145 . . . . 0.31 110.068 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -101.75 162.21 13.07 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 113.982 -3.087 . . . . 0.21 109.762 170.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.514 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -49.26 -42.91 42.3 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 127.453 3.502 . . . . 0.11 112.246 173.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.97 -37.22 68.75 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 111.891 -2.413 . . . . 0.12 114.641 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.455 ' O ' HG13 ' A' ' 108' ' ' VAL . 2.5 tt0 -74.74 -29.26 61.1 Favored 'General case' 0 CA--C 1.495 -1.173 0 CA-C-N 113.638 -1.619 . . . . 0.81 114.146 174.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.673 HD21 ' HE1' ' A' ' 144' ' ' MET . 0.2 OUTLIER -53.88 -52.62 59.88 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 117.283 -1.767 . . . . 0.16 109.398 170.559 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.431 ' HE ' HG21 ' A' ' 121' ' ' VAL . 22.7 ttp85 -52.91 -32.64 46.42 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 115.255 1.576 . . . . 3.52 115.255 173.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -59.29 -54.15 50.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 116.769 -1.973 . . . . 0.49 112.805 170.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' HD23 ' A' ' 112' ' ' LEU . 0.9 OUTLIER -55.45 -35.3 37.04 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 125.33 1.644 . . . . 0.1 111.54 176.549 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.517 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 35.8 mmm -64.01 -41.71 97.37 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 123.461 1.601 . . . . 0.12 113.161 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.409 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 85.3 m -57.1 -43.34 82.15 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 113.617 -1.629 . . . . 0.18 112.872 171.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -60.72 -38.85 86.45 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 123.821 1.772 . . . . 1.12 113.207 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 108' ' ' VAL . 3.2 mm? -68.46 -8.24 39.09 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 112.402 -2.181 . . . . 0.45 112.254 179.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.43 -40.24 2.53 Favored Glycine 0 C--N 1.342 0.906 0 C-N-CA 118.229 -1.939 . . . . 0.41 110.854 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.517 ' O ' ' HB3' ' A' ' 109' ' ' MET . 20.0 mm-40 -97.6 117.71 32.49 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-N 112.451 -1.874 . . . . 2.29 111.524 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 48.3 mtpt -109.96 116.03 30.87 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 117.62 -1.632 . . . . 1.51 110.657 -176.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.6 mp -95.84 152.51 18.43 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 116.098 -2.241 . . . . 3.77 109.187 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.504 ' O ' HG23 ' A' ' 121' ' ' VAL . 81.2 p -74.76 175.91 7.52 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 117.764 -1.574 . . . . 0.3 112.641 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.46 ' O ' ' HB ' ' A' ' 121' ' ' VAL . 56.0 m-20 -50.82 -37.8 45.02 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.017 1.488 . . . . 1.6 115.017 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -54.62 -48.7 71.91 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-O 124.536 2.112 . . . . 1.75 112.54 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.418 ' O ' ' SD ' ' A' ' 124' ' ' MET . 6.4 mm-40 -70.16 -39.05 75.54 Favored 'General case' 0 C--O 1.206 -1.21 0 CA-C-N 110.629 -2.987 . . . . 0.68 111.073 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.599 ' O ' ' HB2' ' A' ' 124' ' ' MET . 80.1 t -51.82 -35.24 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 124.13 1.919 . . . . 0.44 114.556 173.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.84 -44.37 90.01 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.073 -2.251 . . . . 1.29 112.818 169.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -56.92 -28.07 61.6 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 118.475 -1.29 . . . . 3.19 114.149 168.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.599 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -62.63 -42.36 99.55 Favored 'General case' 0 CA--C 1.484 -1.588 0 CA-C-O 117.34 -1.314 . . . . 1.81 111.023 172.639 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.461 ' CG1' ' HB2' ' A' ' 102' ' ' ALA . 17.1 mt -53.92 -46.23 64.27 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.583 0 C-N-CA 116.879 -1.929 . . . . 0.09 110.217 170.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -57.39 13.24 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 115.496 -2.482 . . . . 4.42 116.032 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -65.31 -27.5 68.65 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 124.835 2.255 . . . . 1.95 113.602 -176.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -90.45 -25.99 20.06 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 112.399 -2.182 . . . . 0.11 114.402 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -89.59 90.83 8.43 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 126.814 2.571 . . . . 1.93 111.333 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.6 mp -94.66 -33.74 5.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 122.645 1.212 . . . . 0.45 113.293 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.0 p30 -66.36 -32.6 74.09 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 113.243 -1.798 . . . . 1.15 113.012 174.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.56 65.06 2.14 Favored Glycine 0 C--N 1.345 1.038 0 C-N-CA 116.868 -2.587 . . . . 1.15 113.677 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -119.94 -11.02 9.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 113.253 -1.473 . . . . 2.49 113.68 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.38 19.78 51.14 Favored Glycine 0 C--N 1.354 1.534 0 N-CA-C 116.549 1.38 . . . . 0.31 116.549 -174.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -154.13 162.9 40.88 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.007 1.723 . . . . 1.71 107.81 -173.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.437 HG13 ' HB1' ' A' ' 128' ' ' ALA . 97.3 t -113.96 119.85 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.676 0 C-N-CA 115.251 -2.579 . . . . 0.35 107.218 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -106.71 179.97 4.11 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 114.111 -3.036 . . . . 2.45 114.293 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -68.41 -33.86 74.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 124.185 1.945 . . . . 20.0 114.353 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -61.66 -47.63 84.5 Favored 'General case' 0 CA--C 1.492 -1.282 0 CA-C-N 110.634 -2.985 . . . . 2.9 110.162 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.549 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 80.8 mt-10 -63.38 -30.78 71.85 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-N 111.308 -2.678 . . . . 2.77 114.178 172.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -56.62 -39.21 73.22 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 124.285 1.993 . . . . 0.38 112.458 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.38 -47.63 76.73 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 CA-C-N 111.995 -2.366 . . . . 0.4 111.908 170.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.9 -26.61 67.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.903 1.446 . . . . 1.57 114.903 -177.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.673 ' HE1' HD21 ' A' ' 105' ' ' LEU . 4.7 ttm -74.42 -53.46 9.52 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 124.958 2.314 . . . . 0.79 110.587 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 28.1 mtt -76.66 -50.84 12.74 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 115.823 -2.351 . . . . 0.36 114.143 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.0 m -60.78 -56.53 20.16 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 112.937 -1.938 . . . . 0.82 112.37 176.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.25 -167.21 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 O-C-N 124.842 1.339 . . . . 1.28 112.101 -177.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 10.2 tptt . . . . . 0 C--N 1.346 0.431 0 CA-C-O 118.175 -0.917 . . . . 20.0 112.12 -179.41 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 150' ' ' HLT . . . . . 0.408 ' F2 ' ' SD ' ' A' ' 144' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 CA--C 1.496 -1.102 0 CA-C-O 117.785 -1.102 . . . . 1.97 108.132 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.59 -33.03 74.97 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 125.743 1.902 . . . . 2.22 114.118 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.2 mm-40 -53.59 -56.9 13.19 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 126.24 2.924 . . . . 2.28 112.182 -178.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.7 pt -72.16 -50.33 37.34 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 CA-C-N 111.256 -2.702 . . . . 0.3 114.207 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -73.55 -56.67 4.72 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.053 -1.43 . . . . 2.72 113.897 -174.302 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.02 -37.29 81.22 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 113.846 -1.525 . . . . 3.05 113.851 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.67 -38.32 89.86 Favored 'General case' 0 C--O 1.213 -0.831 0 C-N-CA 113.277 -3.369 . . . . 0.07 109.702 169.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.8 t80 -56.91 -29.76 63.33 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 115.643 1.72 . . . . 0.11 115.643 168.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -67.81 -39.49 83.95 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 117.344 -1.742 . . . . 4.69 112.035 176.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.75 -32.82 58.32 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 114.057 -1.429 . . . . 0.11 111.991 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.597 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -60.52 -49.25 78.32 Favored 'General case' 0 CA--C 1.497 -1.078 0 O-C-N 125.745 1.903 . . . . 0.21 111.635 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -78.99 80.28 5.34 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.325 2.012 . . . . 1.46 109.681 169.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -56.82 -30.56 63.87 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 111.409 -2.632 . . . . 3.98 113.568 -171.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.405 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 13.5 p30 -90.43 -18.33 25.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 113.095 -1.866 . . . . 3.1 113.896 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.17 15.89 76.81 Favored Glycine 0 C--N 1.343 0.927 0 C-N-CA 116.802 -2.618 . . . . 0.46 113.103 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.479 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -64.92 -10.5 29.37 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.011 1.856 . . . . 1.31 116.011 -177.82 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.479 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 90.59 -29.07 7.0 Favored Glycine 0 C--N 1.347 1.178 0 N-CA-C 116.113 1.205 . . . . 0.23 116.113 -172.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -110.07 146.35 35.54 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 113.581 -1.309 . . . . 20.0 111.696 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 37.9 mm -109.26 130.47 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 CA-C-N 112.641 -2.072 . . . . 0.31 110.881 -179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 t -101.43 163.21 12.39 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 114.486 -2.885 . . . . 0.21 108.955 171.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.467 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -50.43 -42.5 54.08 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 127.825 3.678 . . . . 0.11 112.11 176.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -53.58 -37.7 63.21 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.604 -2.544 . . . . 0.12 114.778 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.533 ' O ' HG13 ' A' ' 108' ' ' VAL . 1.7 mt-10 -74.69 -30.52 61.59 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 115.512 1.671 . . . . 0.81 115.512 172.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.646 HD12 ' HG3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -55.65 -35.85 66.4 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 115.825 -2.35 . . . . 0.16 111.673 170.433 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.401 ' NH1' ' OD1' ' A' ' 118' ' ' ASP . 64.4 ttt180 -67.83 -30.47 69.88 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 113.957 -1.474 . . . . 3.52 113.913 172.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.408 ' O ' ' HB ' ' A' ' 110' ' ' THR . 11.8 t-80 -62.32 -50.3 72.18 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 116.979 -1.888 . . . . 0.49 111.142 171.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.569 HG12 ' HB3' ' A' ' 92' ' ' PHE . 0.9 OUTLIER -55.42 -40.59 58.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 CA-C-N 113.623 -1.626 . . . . 0.1 110.687 177.756 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.512 ' SD ' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -60.41 -39.71 88.37 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 125.633 2.635 . . . . 0.12 113.466 174.423 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 107' ' ' HIS . 19.9 m -53.83 -47.99 70.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 112.871 -1.968 . . . . 0.18 113.413 171.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -61.91 -37.23 83.86 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 126.559 2.412 . . . . 1.12 112.96 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.9 mm? -63.55 -11.59 25.68 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 113.874 -1.512 . . . . 0.45 111.781 176.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.05 -34.83 4.94 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 118.637 -1.744 . . . . 0.41 110.36 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 109' ' ' MET . 23.7 mt-10 -108.23 108.45 19.49 Favored 'General case' 0 C--O 1.215 -0.741 0 CA-C-N 112.888 -1.656 . . . . 2.29 109.093 -173.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -89.34 135.52 33.54 Favored 'General case' 0 CA--C 1.498 -1.026 0 C-N-CA 116.44 -2.104 . . . . 1.51 110.895 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.512 HD23 ' SD ' ' A' ' 109' ' ' MET . 1.3 mm? -101.4 155.67 17.92 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 126.534 2.396 . . . . 3.77 109.582 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.533 ' O ' HG23 ' A' ' 121' ' ' VAL . 74.0 p -78.14 170.25 16.92 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 116.592 -2.043 . . . . 0.3 112.044 -173.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.401 ' OD1' ' NH1' ' A' ' 106' ' ' ARG . 50.1 m-20 -55.04 -31.72 61.31 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 114.662 1.356 . . . . 1.6 114.662 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.42 -48.42 81.72 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 125.268 2.461 . . . . 1.75 112.018 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.486 ' O ' ' SD ' ' A' ' 124' ' ' MET . 48.5 mm-40 -67.01 -39.06 86.98 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 109.543 -3.48 . . . . 0.68 111.472 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.642 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.1 t -53.34 -33.87 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 124.371 2.034 . . . . 0.44 114.021 174.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -68.54 -41.81 79.31 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 115.938 -2.305 . . . . 1.29 112.921 170.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -56.96 -26.76 60.39 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 118.092 -1.443 . . . . 3.19 114.385 167.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.646 ' HG3' HD12 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.21 -40.51 96.2 Favored 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 115.371 -0.831 . . . . 1.81 111.003 173.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 102' ' ' ALA . 22.0 mt -53.51 -48.5 58.14 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.439 0 C-N-CA 116.036 -2.266 . . . . 0.09 110.08 168.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -54.53 45.66 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 116.668 2.099 . . . . 4.42 116.668 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.4 -28.06 68.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 123.478 1.609 . . . . 1.95 112.611 -176.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -92.28 -25.4 18.61 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 113.161 -1.836 . . . . 0.11 115.047 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -89.4 92.44 9.14 Favored 'General case' 0 C--N 1.338 0.085 0 O-C-N 126.729 2.518 . . . . 1.93 111.181 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.22 -32.26 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 123.125 1.441 . . . . 0.45 113.354 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -69.08 -30.96 69.39 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 112.832 -1.985 . . . . 1.15 113.632 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.14 63.46 2.66 Favored Glycine 0 C--N 1.345 1.065 0 C-N-CA 117.389 -2.339 . . . . 1.15 114.173 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -118.54 -12.17 9.82 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 113.294 -1.453 . . . . 2.49 113.586 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.17 22.3 38.61 Favored Glycine 0 C--N 1.35 1.347 0 N-CA-C 116.635 1.414 . . . . 0.31 116.635 -175.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -155.98 163.93 39.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.775 1.63 . . . . 1.71 108.267 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 128' ' ' ALA . 90.2 t -115.26 119.36 61.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 116.316 -2.153 . . . . 0.35 108.277 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -105.29 173.76 6.17 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 115.959 -2.297 . . . . 2.45 114.142 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -64.77 -36.56 84.71 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 124.274 1.988 . . . . 20.0 114.276 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.96 -45.5 94.48 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 111.351 -2.659 . . . . 2.9 110.51 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.502 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 64.4 mt-10 -64.63 -31.63 72.94 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-N 110.5 -3.046 . . . . 2.77 114.445 172.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 145' ' ' MET . 9.1 t80 -56.88 -40.7 76.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.953 1.835 . . . . 0.38 111.445 173.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.87 -46.45 88.54 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 CA-C-N 112.802 -1.999 . . . . 0.4 112.326 170.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -57.71 -33.97 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 114.333 1.234 . . . . 1.57 114.333 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.941 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 14.9 ttp -76.95 -48.04 19.22 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 123.796 1.76 . . . . 0.79 111.673 -178.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.859 ' HE1' 'BR ' ' A' ' 150' ' ' HLT . 17.5 mmt -72.15 -56.86 4.86 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.53 -2.068 . . . . 0.36 112.452 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 17.4 m -60.31 -56.33 22.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 111.849 -2.432 . . . . 0.82 112.885 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 57.03 -163.63 0.17 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.396 -1.274 . . . . 1.28 112.031 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.344 0.333 0 CA-C-N 115.19 -0.914 . . . . 20.0 111.625 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 150' ' ' HLT . . . . . 0.941 'BR ' ' SD ' ' A' ' 144' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 107.861 -1.162 . . . . 1.97 107.861 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HB2' ' HB3' ' A' ' 87' ' ' GLU . 2.1 pp20? -67.32 -33.44 75.26 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 126.223 2.202 . . . . 2.22 112.905 174.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.1 mm-40 -53.76 -54.18 41.76 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 125.231 2.443 . . . . 2.28 112.864 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.6 pt -73.38 -49.41 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 114.67 -2.812 . . . . 0.3 114.489 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -53.06 8.31 Favored 'General case' 0 C--O 1.206 -1.187 0 C-N-CA 118.327 -1.349 . . . . 2.72 113.892 -174.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HB3' ' HB2' ' A' ' 83' ' ' GLU . 16.6 tt0 -70.35 -35.53 73.63 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 114.654 1.353 . . . . 3.05 114.654 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -63.0 -39.22 94.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 113.434 -3.307 . . . . 0.07 109.981 166.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.598 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 84.8 t80 -56.17 -30.41 62.19 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.25 1.574 . . . . 0.11 115.25 169.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -37.64 77.92 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 115.683 -2.407 . . . . 4.69 110.553 176.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.1 t -65.1 -34.55 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 116.624 -2.03 . . . . 0.11 113.238 173.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.598 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.1 m-30 -61.23 -48.54 80.98 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 112.103 -2.317 . . . . 0.21 111.228 -178.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -76.42 76.61 3.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 125.034 2.35 . . . . 1.46 111.368 166.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -60.05 -30.09 68.97 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 111.213 -2.721 . . . . 3.98 115.314 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -85.4 -26.21 26.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 112.393 -2.185 . . . . 3.1 112.418 175.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.76 27.08 73.69 Favored Glycine 0 C--N 1.344 1.001 0 CA-C-N 113.223 -1.808 . . . . 0.46 111.685 178.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -68.19 -16.79 64.13 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 125.307 1.24 . . . . 1.31 114.188 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.67 -14.7 64.46 Favored Glycine 0 C--N 1.343 0.962 0 O-C-N 125.422 1.701 . . . . 0.23 113.743 -175.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -114.38 146.76 40.15 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.295 -1.453 . . . . 20.0 109.651 -173.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.9 mm -113.27 135.0 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.768 0 CA-C-N 112.669 -2.06 . . . . 0.31 110.078 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.0 t -107.4 159.72 16.18 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 116.242 -2.183 . . . . 0.21 108.511 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -46.19 -43.45 15.24 Favored 'General case' 0 CA--C 1.548 0.883 1 CA-C-O 128.513 4.006 . . . . 0.11 113.226 177.681 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -54.62 -46.83 73.95 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 110.717 -2.947 . . . . 0.12 115.201 174.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -28.15 69.73 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 115.356 1.613 . . . . 0.81 115.356 172.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.564 ' HG ' ' HB3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -54.64 -50.65 67.62 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 117.185 -1.806 . . . . 0.16 111.0 167.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -54.76 -28.52 49.21 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 117.358 -1.737 . . . . 3.52 115.256 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -62.86 -54.99 30.22 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 116.871 -1.932 . . . . 0.49 111.806 171.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.551 ' O ' HD23 ' A' ' 112' ' ' LEU . 2.7 m -57.68 -33.42 45.0 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 116.728 -1.989 . . . . 0.1 111.171 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.725 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 41.7 mmm -60.58 -44.52 96.11 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 123.292 1.52 . . . . 0.12 113.547 171.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.4 m -55.51 -45.18 77.14 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 113.62 -1.627 . . . . 0.18 112.384 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -59.24 -41.86 89.71 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 123.615 1.674 . . . . 1.12 112.826 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.551 HD23 ' O ' ' A' ' 108' ' ' VAL . 1.6 mm? -64.44 -7.5 10.15 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 112.688 -2.051 . . . . 0.45 112.363 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.8 -35.99 4.06 Favored Glycine 0 C--N 1.339 0.705 0 C-N-CA 117.835 -2.126 . . . . 0.41 110.796 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 109' ' ' MET . 33.2 mm-40 -108.5 111.07 22.75 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.574 -1.813 . . . . 2.29 110.645 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -93.32 130.12 39.18 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 113.932 -1.485 . . . . 1.51 111.056 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.478 HD23 ' HE2' ' A' ' 109' ' ' MET . 4.4 mm? -95.02 153.16 17.77 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 116.375 -2.13 . . . . 3.77 109.82 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.536 ' O ' HG23 ' A' ' 121' ' ' VAL . 44.6 p -76.21 169.57 17.96 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 113.725 -1.579 . . . . 0.3 112.333 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -52.48 -33.92 46.83 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.702 1.371 . . . . 1.6 114.702 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -52.31 65.99 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 126.751 3.167 . . . . 1.75 111.125 176.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 124' ' ' MET . 12.2 mm-40 -61.73 -35.71 78.86 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 109.286 -3.597 . . . . 0.68 112.526 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.623 HG12 ' HB1' ' A' ' 102' ' ' ALA . 88.3 t -55.12 -36.33 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 123.5 1.619 . . . . 0.44 114.15 176.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.08 -44.9 78.88 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 112.415 -2.175 . . . . 1.29 111.628 172.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -57.4 -28.74 63.5 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 118.146 -1.421 . . . . 3.19 114.281 168.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.564 ' HB3' ' HG ' ' A' ' 105' ' ' LEU . 25.9 mmt -65.96 -37.03 84.94 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 115.253 -0.885 . . . . 1.81 110.709 178.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 14.3 mt -56.82 -50.23 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 116.151 -2.22 . . . . 0.09 109.736 168.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -37.73 73.79 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 116.029 1.863 . . . . 4.42 116.029 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -78.72 -32.1 46.71 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-O 124.709 2.195 . . . . 1.95 112.226 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -89.08 -26.6 21.29 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 112.705 -2.043 . . . . 0.11 114.092 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -86.53 91.27 8.5 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 126.612 2.445 . . . . 1.93 111.45 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.0 mp -95.5 -32.94 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-N 114.019 -1.446 . . . . 0.45 112.791 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -67.83 -33.44 74.78 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 113.253 -1.794 . . . . 1.15 113.73 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.09 64.57 2.28 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 118.179 -1.962 . . . . 1.15 113.419 -176.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -119.48 -10.95 9.56 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 113.705 -1.248 . . . . 2.49 113.595 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.39 22.72 39.57 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 116.616 1.406 . . . . 0.31 116.616 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -156.3 164.87 37.8 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.084 1.354 . . . . 1.71 107.668 -174.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.473 HG13 ' HB1' ' A' ' 128' ' ' ALA . 94.3 t -115.54 119.54 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 115.84 -2.344 . . . . 0.35 107.133 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -104.78 175.14 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 116.001 -2.28 . . . . 2.45 114.969 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.68 -35.2 80.27 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 123.279 1.514 . . . . 20.0 113.899 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -62.94 -46.75 86.28 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 111.962 -2.381 . . . . 2.9 110.466 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 60.8 mt-10 -60.44 -31.07 70.07 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 110.394 -3.094 . . . . 2.77 114.854 171.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.96 -41.16 74.3 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 124.204 1.955 . . . . 0.38 112.195 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.7 t -69.13 -49.69 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 112.239 -2.255 . . . . 0.4 112.109 171.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.414 ' HB3' ' HA ' ' A' ' 140' ' ' GLU . 12.5 tp60 -56.06 -27.35 53.04 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 114.205 -1.362 . . . . 1.57 114.671 -178.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -53.3 8.66 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 124.155 1.931 . . . . 0.79 110.899 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 33.0 mtt -76.47 -54.29 6.93 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 114.614 -2.834 . . . . 0.36 114.731 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 23.3 m -57.08 -59.74 4.63 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.345 -1.752 . . . . 0.82 112.686 173.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 52.66 -159.09 0.13 Allowed 'General case' 0 C--N 1.345 0.376 0 O-C-N 124.884 1.365 . . . . 1.28 111.47 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt . . . . . 0 C--N 1.347 0.49 0 CA-C-O 118.462 -0.78 . . . . 20.0 111.052 175.074 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 150' ' ' HLT . . . . . 0.725 'BR ' ' SD ' ' A' ' 109' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 . . . . . 0 CA--C 1.502 -0.897 0 N-CA-C 106.95 -1.5 . . . . 1.97 106.95 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -37.13 47.88 Favored 'General case' 0 C--O 1.218 -0.571 0 O-C-N 125.895 1.997 . . . . 2.22 114.013 168.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -50.63 -59.74 3.75 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 123.943 1.83 . . . . 2.28 111.778 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.9 pt -73.02 -49.25 40.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 116.242 -2.183 . . . . 0.3 115.481 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.43 -55.05 7.66 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 113.269 -1.787 . . . . 2.72 113.948 -175.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -70.12 -35.27 73.99 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 117.9 -1.52 . . . . 3.05 113.807 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.69 92.9 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 113.974 -3.091 . . . . 0.07 109.305 170.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.55 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 76.4 t80 -56.45 -32.09 64.6 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 114.998 1.481 . . . . 0.11 114.998 168.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -65.96 -36.88 84.54 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 115.6 -2.44 . . . . 4.69 113.521 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.1 t -70.26 -28.41 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 117.809 -1.556 . . . . 0.11 113.058 171.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.55 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.8 m-30 -63.03 -49.98 72.5 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 113.067 -1.879 . . . . 0.21 111.571 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -76.5 79.32 3.2 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 126.959 2.662 . . . . 1.46 109.796 167.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -58.19 -30.46 66.47 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 111.435 -2.621 . . . . 3.98 113.879 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.418 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 21.3 p-10 -91.48 -17.39 25.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 113.525 -1.671 . . . . 3.1 113.756 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.66 20.47 79.63 Favored Glycine 0 C--N 1.343 0.931 0 C-N-CA 117.486 -2.292 . . . . 0.46 112.828 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.448 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.66 -9.22 12.78 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 116.321 1.971 . . . . 1.31 116.321 -178.319 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.448 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 91.18 -31.3 5.75 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 124.821 1.326 . . . . 0.23 115.056 -171.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -110.81 145.87 37.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 112.806 -1.697 . . . . 20.0 112.651 -172.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' A' ' 104' ' ' GLU . 13.6 mm -102.88 133.84 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-N 112.146 -2.297 . . . . 0.31 110.01 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.9 t -107.23 159.12 16.59 Favored 'General case' 0 CA--C 1.503 -0.832 0 C-N-CA 115.197 -2.601 . . . . 0.21 108.017 170.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.445 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -47.53 -42.47 23.39 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 127.927 3.727 . . . . 0.11 112.141 178.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.07 87.42 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-N 111.593 -2.549 . . . . 0.12 115.174 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.579 ' OE1' HD13 ' A' ' 100' ' ' ILE . 4.4 tt0 -66.26 -25.46 66.89 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 114.986 1.476 . . . . 0.81 114.986 171.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 1.055 HD11 'BR ' ' A' ' 150' ' ' HLT . 0.2 OUTLIER -56.33 -45.83 80.16 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 116.293 -2.163 . . . . 0.16 111.306 167.298 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 -55.8 -28.22 55.11 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.176 1.941 . . . . 3.52 115.327 171.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.401 ' O ' ' HB ' ' A' ' 110' ' ' THR . 55.7 t60 -65.1 -52.2 56.86 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 116.313 -2.155 . . . . 0.49 112.008 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.648 HG22 HD13 ' A' ' 105' ' ' LEU . 1.2 m -55.65 -36.68 43.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.834 0 C-N-CA 116.233 -2.187 . . . . 0.1 111.612 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.789 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 50.0 mmm -60.24 -44.54 95.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 125.211 2.434 . . . . 0.12 113.581 173.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 107' ' ' HIS . 80.8 m -51.1 -47.01 62.02 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 112.815 -1.993 . . . . 0.18 113.053 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.41 -39.24 90.05 Favored 'General case' 0 C--O 1.216 -0.661 0 O-C-N 125.837 1.96 . . . . 1.12 113.443 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.481 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.6 mm? -67.08 -7.96 26.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 123.38 1.562 . . . . 0.45 112.274 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 97.78 -37.92 3.29 Favored Glycine 0 C--N 1.342 0.865 0 C-N-CA 118.514 -1.803 . . . . 0.41 110.8 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.51 ' O ' ' HB3' ' A' ' 109' ' ' MET . 74.4 mm-40 -105.79 116.12 31.4 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-N 112.196 -2.002 . . . . 2.29 109.363 -173.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -94.41 128.91 41.25 Favored 'General case' 0 CA--C 1.502 -0.89 0 C-N-CA 115.718 -2.393 . . . . 1.51 111.239 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' A' ' 124' ' ' MET . 39.3 mt -93.2 157.89 16.04 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 116.193 -2.203 . . . . 3.77 109.949 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.6 p -81.02 175.09 10.99 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 117.312 -1.755 . . . . 0.3 111.406 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -58.44 -29.97 66.55 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 114.725 1.38 . . . . 1.6 114.725 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.72 -50.98 71.73 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-O 124.991 2.329 . . . . 1.75 111.095 175.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.48 ' O ' ' SD ' ' A' ' 124' ' ' MET . 17.6 mm-40 -63.51 -43.23 97.82 Favored 'General case' 0 C--O 1.207 -1.174 0 CA-C-N 109.716 -3.402 . . . . 0.68 110.693 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.604 ' O ' ' HB2' ' A' ' 124' ' ' MET . 72.6 t -51.51 -34.7 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 124.468 2.08 . . . . 0.44 115.022 174.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -65.35 -45.6 83.54 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 116.402 -2.119 . . . . 1.29 112.021 170.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -56.06 -29.09 60.0 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.262 -1.375 . . . . 3.19 114.008 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.604 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -63.07 -39.35 94.45 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 112.06 0.393 . . . . 1.81 112.06 174.399 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 24.2 mt -53.91 -48.95 62.32 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.573 0 C-N-CA 115.6 -2.44 . . . . 0.09 109.636 169.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -57.23 13.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 117.949 2.574 . . . . 4.42 117.949 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.92 -29.15 70.07 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.97 1.366 . . . . 1.95 112.191 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.542 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -91.2 -23.86 20.09 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 113.411 -1.722 . . . . 0.11 115.176 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -90.58 92.5 8.88 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 126.092 2.12 . . . . 1.93 111.743 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.443 HG21 ' HG2' ' A' ' 143' ' ' GLN . 3.8 mp -94.08 -34.32 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 123.355 1.55 . . . . 0.45 113.441 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -67.6 -31.61 71.77 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 113.448 -1.705 . . . . 1.15 113.291 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.47 64.71 2.32 Favored Glycine 0 C--N 1.343 0.921 0 C-N-CA 117.583 -2.246 . . . . 1.15 114.101 -176.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -119.7 -10.39 9.58 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 125.259 1.211 . . . . 2.49 113.731 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 21.52 47.07 Favored Glycine 0 C--N 1.354 1.547 0 N-CA-C 116.962 1.545 . . . . 0.31 116.962 -174.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -155.22 164.25 39.07 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.04 1.736 . . . . 1.71 108.564 -175.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.542 HG13 ' HB1' ' A' ' 128' ' ' ALA . 97.4 t -115.31 121.68 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 C-N-CA 116.629 -2.029 . . . . 0.35 107.883 -178.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -109.26 173.88 6.12 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 115.26 -2.576 . . . . 2.45 114.477 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -64.63 -35.38 80.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 123.998 1.856 . . . . 20.0 114.441 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -62.78 -44.68 95.53 Favored 'General case' 0 CA--C 1.492 -1.273 0 CA-C-N 111.69 -2.504 . . . . 2.9 110.311 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.512 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 70.3 mt-10 -62.66 -30.65 71.54 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 110.971 -2.831 . . . . 2.77 114.023 172.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -58.02 -37.53 74.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 124.494 2.093 . . . . 0.38 112.749 171.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.99 -49.71 54.08 Favored 'Isoleucine or valine' 0 C--N 1.345 0.397 0 CA-C-N 112.277 -2.238 . . . . 0.4 112.363 169.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.443 ' HG2' HG21 ' A' ' 130' ' ' ILE . 0.4 OUTLIER -58.06 -26.71 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.616 1.339 . . . . 1.57 114.616 -177.209 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.682 ' SD ' 'CL ' ' A' ' 150' ' ' HLT . 6.0 ttp -77.11 -49.74 14.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 122.993 1.377 . . . . 0.79 111.657 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 mtt -77.22 -52.4 9.29 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 115.883 -2.327 . . . . 0.36 114.627 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.3 m -57.72 -53.38 58.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 113.117 -1.856 . . . . 0.82 112.736 174.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.62 -168.7 0.1 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 125.342 1.651 . . . . 1.28 111.911 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? . . . . . 0 C--N 1.348 0.519 0 CA-C-N 115.498 -0.774 . . . . 20.0 112.138 -177.517 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 150' ' ' HLT . . . . . 1.055 'BR ' HD11 ' A' ' 105' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 CA--C 1.48 -1.744 0 CA-C-O 119.614 -0.232 . . . . 1.97 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -65.22 -35.69 81.84 Favored 'General case' 0 C--O 1.217 -0.655 0 O-C-N 126.337 2.273 . . . . 2.22 112.268 171.417 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 5.8 mm-40 -53.83 -55.33 27.62 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 126.056 2.836 . . . . 2.28 112.295 -176.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.4 pt -72.21 -52.18 25.81 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 111.214 -2.721 . . . . 0.3 114.288 175.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -75.19 -54.99 6.18 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 117.301 -1.76 . . . . 2.72 114.206 -174.672 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 83' ' ' GLU . 21.1 tt0 -67.11 -34.69 78.14 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 117.962 -1.495 . . . . 3.05 114.882 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.7 -40.83 98.35 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 112.781 -3.568 . . . . 0.07 109.918 168.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.622 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 83.2 t80 -53.95 -31.55 50.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.744 1.757 . . . . 0.11 115.744 168.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -67.75 -36.93 81.43 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 117.651 -1.62 . . . . 4.69 112.618 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.57 -33.21 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 118.004 -1.478 . . . . 0.11 112.618 170.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.622 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.3 m-30 -59.95 -49.92 75.78 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 112.731 -2.031 . . . . 0.21 110.99 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -78.27 78.17 4.75 Favored 'General case' 0 CA--C 1.509 -0.619 0 O-C-N 125.813 1.946 . . . . 1.46 110.203 170.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -57.76 -29.68 65.01 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 112.361 -2.2 . . . . 3.98 114.605 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.419 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 19.9 p30 -89.15 -18.06 27.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 112.646 -2.07 . . . . 3.1 114.229 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 71.68 17.43 76.59 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 117.575 -2.25 . . . . 0.46 112.849 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.47 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -65.28 -8.86 19.86 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 115.813 1.783 . . . . 1.31 115.813 -177.522 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.47 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 88.74 -29.32 5.89 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 116.121 1.209 . . . . 0.23 116.121 -173.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.412 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 42.8 m-85 -110.43 146.79 35.27 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 113.4 -1.4 . . . . 20.0 111.79 -175.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.403 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 32.4 mm -114.95 132.18 64.95 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 CA-C-N 112.225 -2.261 . . . . 0.31 110.231 -177.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -103.78 167.99 9.43 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 113.856 -3.137 . . . . 0.21 110.907 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.751 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -48.63 -42.65 34.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 127.528 3.537 . . . . 0.11 113.225 175.136 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -51.84 -41.7 62.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.572 -2.558 . . . . 0.12 115.284 174.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.546 ' O ' HG13 ' A' ' 108' ' ' VAL . 2.5 mt-10 -76.8 -28.79 55.74 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 113.618 -1.628 . . . . 0.81 114.927 173.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.575 HD23 HG11 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -56.05 -29.03 59.87 Favored 'General case' 0 C--O 1.221 -0.419 0 O-C-N 124.91 1.381 . . . . 0.16 111.956 168.669 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.95 ' NH2' ' OD1' ' A' ' 118' ' ' ASP . 35.1 ttm-85 -74.25 -34.24 63.55 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 114.296 -1.32 . . . . 3.52 113.244 171.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.497 ' O ' ' HB ' ' A' ' 110' ' ' THR . 12.3 t-160 -61.37 -46.47 90.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 116.421 -2.112 . . . . 0.49 111.006 172.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 105' ' ' LEU . 1.1 m -59.19 -38.52 74.81 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 113.74 -1.573 . . . . 0.1 110.814 175.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.495 ' SD ' ' HG ' ' A' ' 116' ' ' LEU . 2.0 mmt -58.18 -40.5 81.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 124.616 2.151 . . . . 0.12 114.493 173.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.54 HG23 ' HE3' ' A' ' 115' ' ' LYS . 52.8 m -52.98 -47.44 68.2 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 113.056 -1.884 . . . . 0.18 112.733 171.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -62.08 -38.01 87.18 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 126.958 2.661 . . . . 1.12 114.028 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.73 -14.46 52.58 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 113.355 -1.748 . . . . 0.45 111.937 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.11 -36.95 3.91 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 118.176 -1.964 . . . . 0.41 110.825 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 109' ' ' MET . 1.4 mt-10 -106.65 110.12 22.22 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 112.717 -1.741 . . . . 2.29 109.377 -173.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.54 ' HE3' HG23 ' A' ' 110' ' ' THR . 33.8 mttp -94.44 119.95 33.93 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 116.153 -2.219 . . . . 1.51 110.036 177.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.495 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 14.0 mt -95.53 161.0 14.24 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 114.424 -2.91 . . . . 3.77 109.893 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.5 p -76.39 176.98 7.7 Favored 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 117.378 -1.729 . . . . 0.3 111.751 -174.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.95 ' OD1' ' NH2' ' A' ' 106' ' ' ARG . 1.5 m-20 -50.8 -39.19 52.19 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 115.061 1.504 . . . . 1.6 115.061 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.76 -54.05 39.38 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-O 125.928 2.775 . . . . 1.75 110.493 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.68 -33.83 76.52 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 109.724 -3.398 . . . . 0.68 113.343 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.751 HG12 ' HB1' ' A' ' 102' ' ' ALA . 94.3 t -56.09 -35.67 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 123.517 1.627 . . . . 0.44 114.694 171.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -64.3 -44.22 92.31 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 112.306 -2.225 . . . . 1.29 111.804 170.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.68 -29.3 66.52 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 117.317 -1.753 . . . . 3.19 114.077 168.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.441 ' SD ' ' HA ' ' A' ' 121' ' ' VAL . 39.4 mtt -68.76 -32.27 71.9 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 117.857 -1.068 . . . . 1.81 112.176 176.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 102' ' ' ALA . 37.8 mt -55.99 -51.02 65.98 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 117.132 -1.827 . . . . 0.09 108.666 166.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.593 ' C ' HH11 ' A' ' 126' ' ' ARG . 0.0 OUTLIER -54.6 -60.78 2.88 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 116.653 -2.019 . . . . 4.42 113.825 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.42 ' HA ' ' NH1' ' A' ' 126' ' ' ARG . 6.7 tp10 -61.76 -25.71 67.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.482 2.087 . . . . 1.95 113.726 -174.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.535 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -91.54 -23.19 20.0 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 113.001 -1.909 . . . . 0.11 115.381 176.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -92.27 93.39 8.63 Favored 'General case' 0 CA--C 1.523 -0.09 0 O-C-N 126.12 2.138 . . . . 1.93 110.096 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.3 mp -95.66 -34.47 5.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 114.392 -1.276 . . . . 0.45 113.245 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -66.64 -31.15 71.66 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 113.185 -1.825 . . . . 1.15 113.3 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.45 64.75 2.41 Favored Glycine 0 C--N 1.344 0.982 0 C-N-CA 117.996 -2.049 . . . . 1.15 113.6 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 p-10 -118.44 -12.2 9.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.254 -0.973 . . . . 2.49 113.611 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.83 19.27 48.34 Favored Glycine 0 C--N 1.355 1.614 0 N-CA-C 117.018 1.567 . . . . 0.31 117.018 -174.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -152.7 165.09 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.864 1.666 . . . . 1.71 108.477 -175.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.575 HG11 HD23 ' A' ' 105' ' ' LEU . 84.4 t -114.43 122.0 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 O-C-N 126.181 2.176 . . . . 0.35 108.349 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -109.59 174.51 5.83 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 114.239 -2.985 . . . . 2.45 112.581 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.433 ' HD2' ' OE2' ' A' ' 139' ' ' GLU . 34.3 t80 -65.51 -36.9 85.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.425 1.583 . . . . 20.0 113.875 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.433 ' OE2' ' HD2' ' A' ' 138' ' ' TYR . 12.7 mm-40 -62.56 -46.07 90.03 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 111.83 -2.441 . . . . 2.9 109.94 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.534 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 71.3 mt-10 -63.21 -30.64 71.74 Favored 'General case' 0 CA--C 1.501 -0.921 0 CA-C-N 111.252 -2.704 . . . . 2.77 114.468 172.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.55 ' O ' ' HG3' ' A' ' 145' ' ' MET . 10.0 t80 -58.68 -38.07 77.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 124.195 1.95 . . . . 0.38 111.954 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 139' ' ' GLU . 86.8 t -69.32 -47.55 72.72 Favored 'Isoleucine or valine' 0 C--N 1.344 0.365 0 CA-C-N 112.928 -1.942 . . . . 0.4 111.182 171.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.21 -30.53 64.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.522 1.304 . . . . 1.57 114.522 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.85 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 15.1 ttp -77.78 -46.52 21.4 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 123.792 1.758 . . . . 0.79 111.379 -179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 141' ' ' PHE . 2.0 mtt -76.83 -52.34 9.68 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 115.833 -2.347 . . . . 0.36 113.467 -179.063 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.5 m -58.79 -52.04 67.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 112.274 -2.239 . . . . 0.82 112.834 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.68 -162.41 0.18 Allowed 'General case' 0 C--O 1.233 0.223 0 O-C-N 125.064 1.477 . . . . 1.28 111.128 -178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 12.5 tptt . . . . . 0 C--N 1.344 0.345 0 CA-C-O 118.334 -0.841 . . . . 20.0 111.51 179.827 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 150' ' ' HLT . . . . . 0.85 'BR ' ' SD ' ' A' ' 144' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 . . . . . 0 CA--C 1.492 -1.271 0 N-CA-C 108.237 -1.023 . . . . 1.97 108.237 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -65.73 -33.59 76.24 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 125.909 2.006 . . . . 2.22 113.957 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 48.8 mm-40 -52.75 -55.82 20.05 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-O 125.955 2.788 . . . . 2.28 112.068 -178.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 pt -73.92 -48.73 37.65 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 CA-C-N 111.272 -2.695 . . . . 0.3 114.461 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -76.46 -55.57 5.42 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 117.764 -1.574 . . . . 2.72 113.894 -174.731 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -63.91 -41.1 97.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.149 -1.387 . . . . 3.05 112.862 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.42 -37.97 87.89 Favored 'General case' 0 C--O 1.213 -0.866 0 C-N-CA 113.009 -3.477 . . . . 0.07 110.04 172.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.588 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.7 t80 -54.71 -30.32 55.63 Favored 'General case' 0 C--N 1.349 0.567 0 N-CA-C 116.053 1.871 . . . . 0.11 116.053 167.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -67.88 -39.69 83.64 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 117.585 -1.646 . . . . 4.69 111.894 174.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 27.4 t -67.71 -29.88 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 118.192 -1.403 . . . . 0.11 112.926 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.588 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -63.03 -50.92 68.78 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 113.372 -1.74 . . . . 0.21 110.358 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -80.58 79.09 7.25 Favored 'General case' 0 CA--C 1.51 -0.564 0 O-C-N 126.303 2.252 . . . . 1.46 110.716 168.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -55.71 -33.69 64.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 111.12 -2.764 . . . . 3.98 114.317 -174.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.427 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 22.8 p-10 -90.11 -17.89 26.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 112.781 -2.008 . . . . 3.1 113.231 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.97 23.46 77.02 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 117.701 -2.19 . . . . 0.46 111.939 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.469 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.92 -9.74 17.12 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 115.469 1.655 . . . . 1.31 115.469 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.469 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 87.19 -26.69 6.68 Favored Glycine 0 C--N 1.348 1.239 0 N-CA-C 116.413 1.325 . . . . 0.23 116.413 -171.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.427 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 41.9 m-85 -110.56 145.19 38.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 123.351 1.548 . . . . 20.0 111.845 -176.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.435 HD11 ' CE1' ' A' ' 89' ' ' PHE . 27.6 mm -105.43 131.53 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 112.482 -2.145 . . . . 0.31 110.068 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -101.75 162.21 13.07 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 113.982 -3.087 . . . . 0.21 109.762 170.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.514 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -49.26 -42.91 42.3 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 127.453 3.502 . . . . 0.11 112.246 173.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.97 -37.22 68.75 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 111.891 -2.413 . . . . 0.12 114.641 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.455 ' O ' HG13 ' A' ' 108' ' ' VAL . 2.5 tt0 -74.74 -29.26 61.1 Favored 'General case' 0 CA--C 1.495 -1.173 0 CA-C-N 113.638 -1.619 . . . . 0.81 114.146 174.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.673 HD21 ' HE1' ' A' ' 144' ' ' MET . 0.2 OUTLIER -53.88 -52.62 59.88 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 117.283 -1.767 . . . . 0.16 109.398 170.559 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.431 ' HE ' HG21 ' A' ' 121' ' ' VAL . 22.7 ttp85 -52.91 -32.64 46.42 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 115.255 1.576 . . . . 3.52 115.255 173.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -59.29 -54.15 50.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 116.769 -1.973 . . . . 0.49 112.805 170.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' HD23 ' A' ' 112' ' ' LEU . 0.9 OUTLIER -55.45 -35.3 37.04 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 125.33 1.644 . . . . 0.1 111.54 176.549 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.517 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 35.8 mmm -64.01 -41.71 97.37 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 123.461 1.601 . . . . 0.12 113.161 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.409 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 85.3 m -57.1 -43.34 82.15 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 113.617 -1.629 . . . . 0.18 112.872 171.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -60.72 -38.85 86.45 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 123.821 1.772 . . . . 1.12 113.207 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 108' ' ' VAL . 3.2 mm? -68.46 -8.24 39.09 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 112.402 -2.181 . . . . 0.45 112.254 179.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.43 -40.24 2.53 Favored Glycine 0 C--N 1.342 0.906 0 C-N-CA 118.229 -1.939 . . . . 0.41 110.854 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.517 ' O ' ' HB3' ' A' ' 109' ' ' MET . 20.0 mm-40 -97.6 117.71 32.49 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-N 112.451 -1.874 . . . . 2.29 111.524 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 48.3 mtpt -109.96 116.03 30.87 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 117.62 -1.632 . . . . 1.51 110.657 -176.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.6 mp -95.84 152.51 18.43 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 116.098 -2.241 . . . . 3.77 109.187 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.504 ' O ' HG23 ' A' ' 121' ' ' VAL . 81.2 p -74.76 175.91 7.52 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 117.764 -1.574 . . . . 0.3 112.641 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.46 ' O ' ' HB ' ' A' ' 121' ' ' VAL . 56.0 m-20 -50.82 -37.8 45.02 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.017 1.488 . . . . 1.6 115.017 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -54.62 -48.7 71.91 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-O 124.536 2.112 . . . . 1.75 112.54 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.418 ' O ' ' SD ' ' A' ' 124' ' ' MET . 6.4 mm-40 -70.16 -39.05 75.54 Favored 'General case' 0 C--O 1.206 -1.21 0 CA-C-N 110.629 -2.987 . . . . 0.68 111.073 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.599 ' O ' ' HB2' ' A' ' 124' ' ' MET . 80.1 t -51.82 -35.24 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 124.13 1.919 . . . . 0.44 114.556 173.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.84 -44.37 90.01 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.073 -2.251 . . . . 1.29 112.818 169.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -56.92 -28.07 61.6 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 118.475 -1.29 . . . . 3.19 114.149 168.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.599 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -62.63 -42.36 99.55 Favored 'General case' 0 CA--C 1.484 -1.588 0 CA-C-O 117.34 -1.314 . . . . 1.81 111.023 172.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.461 ' CG1' ' HB2' ' A' ' 102' ' ' ALA . 17.1 mt -53.92 -46.23 64.27 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.583 0 C-N-CA 116.879 -1.929 . . . . 0.09 110.217 170.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -57.39 13.24 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 115.496 -2.482 . . . . 4.42 116.032 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -65.31 -27.5 68.65 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 124.835 2.255 . . . . 1.95 113.602 -176.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -90.45 -25.99 20.06 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 112.399 -2.182 . . . . 0.11 114.402 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -89.59 90.83 8.43 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 126.814 2.571 . . . . 1.93 111.333 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.6 mp -94.66 -33.74 5.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 122.645 1.212 . . . . 0.45 113.293 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.0 p30 -66.36 -32.6 74.09 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 113.243 -1.798 . . . . 1.15 113.012 174.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.56 65.06 2.14 Favored Glycine 0 C--N 1.345 1.038 0 C-N-CA 116.868 -2.587 . . . . 1.15 113.677 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -119.94 -11.02 9.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 113.253 -1.473 . . . . 2.49 113.68 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.38 19.78 51.14 Favored Glycine 0 C--N 1.354 1.534 0 N-CA-C 116.549 1.38 . . . . 0.31 116.549 -174.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -154.13 162.9 40.88 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.007 1.723 . . . . 1.71 107.81 -173.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.437 HG13 ' HB1' ' A' ' 128' ' ' ALA . 97.3 t -113.96 119.85 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.676 0 C-N-CA 115.251 -2.579 . . . . 0.35 107.218 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -106.71 179.97 4.11 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 114.111 -3.036 . . . . 2.45 114.293 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -68.41 -33.86 74.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 124.185 1.945 . . . . 20.0 114.353 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -61.66 -47.63 84.5 Favored 'General case' 0 CA--C 1.492 -1.282 0 CA-C-N 110.634 -2.985 . . . . 2.9 110.162 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.549 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 80.8 mt-10 -63.38 -30.78 71.85 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-N 111.308 -2.678 . . . . 2.77 114.178 172.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -56.62 -39.21 73.22 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 124.285 1.993 . . . . 0.38 112.458 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.38 -47.63 76.73 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 CA-C-N 111.995 -2.366 . . . . 0.4 111.908 170.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -60.9 -26.61 67.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.903 1.446 . . . . 1.57 114.903 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.673 ' HE1' HD21 ' A' ' 105' ' ' LEU . 4.7 ttm -74.42 -53.46 9.52 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 124.958 2.314 . . . . 0.79 110.587 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 28.1 mtt -76.66 -50.84 12.74 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 115.823 -2.351 . . . . 0.36 114.143 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.0 m -60.78 -56.53 20.16 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 112.937 -1.938 . . . . 0.82 112.37 176.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.25 -167.21 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 O-C-N 124.842 1.339 . . . . 1.28 112.101 -177.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 10.2 tptt . . . . . 0 C--N 1.346 0.431 0 CA-C-O 118.175 -0.917 . . . . 20.0 112.12 -179.41 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 CA--C 1.496 -1.102 0 CA-C-O 117.785 -1.102 . . . . 1.97 108.132 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.59 -33.03 74.97 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 125.743 1.902 . . . . 2.22 114.118 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.2 mm-40 -53.59 -56.9 13.19 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 126.24 2.924 . . . . 2.28 112.182 -178.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.7 pt -72.16 -50.33 37.34 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 CA-C-N 111.256 -2.702 . . . . 0.3 114.207 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -73.55 -56.67 4.72 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.053 -1.43 . . . . 2.72 113.897 -174.302 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.02 -37.29 81.22 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 113.846 -1.525 . . . . 3.05 113.851 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.67 -38.32 89.86 Favored 'General case' 0 C--O 1.213 -0.831 0 C-N-CA 113.277 -3.369 . . . . 0.07 109.702 169.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.8 t80 -56.91 -29.76 63.33 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 115.643 1.72 . . . . 0.11 115.643 168.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -67.81 -39.49 83.95 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 117.344 -1.742 . . . . 4.69 112.035 176.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.75 -32.82 58.32 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 114.057 -1.429 . . . . 0.11 111.991 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.597 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -60.52 -49.25 78.32 Favored 'General case' 0 CA--C 1.497 -1.078 0 O-C-N 125.745 1.903 . . . . 0.21 111.635 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -78.99 80.28 5.34 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.325 2.012 . . . . 1.46 109.681 169.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -56.82 -30.56 63.87 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 111.409 -2.632 . . . . 3.98 113.568 -171.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.405 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 13.5 p30 -90.43 -18.33 25.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 113.095 -1.866 . . . . 3.1 113.896 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.17 15.89 76.81 Favored Glycine 0 C--N 1.343 0.927 0 C-N-CA 116.802 -2.618 . . . . 0.46 113.103 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.479 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -64.92 -10.5 29.37 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.011 1.856 . . . . 1.31 116.011 -177.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.479 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 90.59 -29.07 7.0 Favored Glycine 0 C--N 1.347 1.178 0 N-CA-C 116.113 1.205 . . . . 0.23 116.113 -172.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -110.07 146.35 35.54 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 113.581 -1.309 . . . . 20.0 111.696 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 37.9 mm -109.26 130.47 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 CA-C-N 112.641 -2.072 . . . . 0.31 110.881 -179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 t -101.43 163.21 12.39 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 114.486 -2.885 . . . . 0.21 108.955 171.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.467 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -50.43 -42.5 54.08 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 127.825 3.678 . . . . 0.11 112.11 176.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -53.58 -37.7 63.21 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.604 -2.544 . . . . 0.12 114.778 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.533 ' O ' HG13 ' A' ' 108' ' ' VAL . 1.7 mt-10 -74.69 -30.52 61.59 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 115.512 1.671 . . . . 0.81 115.512 172.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.646 HD12 ' HG3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -55.65 -35.85 66.4 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 115.825 -2.35 . . . . 0.16 111.673 170.433 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.401 ' NH1' ' OD1' ' A' ' 118' ' ' ASP . 64.4 ttt180 -67.83 -30.47 69.88 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 113.957 -1.474 . . . . 3.52 113.913 172.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.408 ' O ' ' HB ' ' A' ' 110' ' ' THR . 22.4 t60 -62.32 -50.3 72.18 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 116.979 -1.888 . . . . 0.49 111.142 171.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.569 HG12 ' HB3' ' A' ' 92' ' ' PHE . 0.9 OUTLIER -55.42 -40.59 58.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 CA-C-N 113.623 -1.626 . . . . 0.1 110.687 177.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.512 ' SD ' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -60.41 -39.71 88.37 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 125.633 2.635 . . . . 0.12 113.466 174.423 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 107' ' ' HIS . 19.9 m -53.83 -47.99 70.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 112.871 -1.968 . . . . 0.18 113.413 171.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -61.91 -37.23 83.86 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 126.559 2.412 . . . . 1.12 112.96 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.9 mm? -63.55 -11.59 25.68 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 113.874 -1.512 . . . . 0.45 111.781 176.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.05 -34.83 4.94 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 118.637 -1.744 . . . . 0.41 110.36 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 109' ' ' MET . 23.7 mt-10 -108.23 108.45 19.49 Favored 'General case' 0 C--O 1.215 -0.741 0 CA-C-N 112.888 -1.656 . . . . 2.29 109.093 -173.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -89.34 135.52 33.54 Favored 'General case' 0 CA--C 1.498 -1.026 0 C-N-CA 116.44 -2.104 . . . . 1.51 110.895 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.512 HD23 ' SD ' ' A' ' 109' ' ' MET . 1.3 mm? -101.4 155.67 17.92 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 126.534 2.396 . . . . 3.77 109.582 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.533 ' O ' HG23 ' A' ' 121' ' ' VAL . 74.0 p -78.14 170.25 16.92 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 116.592 -2.043 . . . . 0.3 112.044 -173.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.401 ' OD1' ' NH1' ' A' ' 106' ' ' ARG . 50.1 m-20 -55.04 -31.72 61.31 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 114.662 1.356 . . . . 1.6 114.662 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.42 -48.42 81.72 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 125.268 2.461 . . . . 1.75 112.018 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.486 ' O ' ' SD ' ' A' ' 124' ' ' MET . 48.5 mm-40 -67.01 -39.06 86.98 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 109.543 -3.48 . . . . 0.68 111.472 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.642 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.1 t -53.34 -33.87 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 124.371 2.034 . . . . 0.44 114.021 174.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -68.54 -41.81 79.31 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 115.938 -2.305 . . . . 1.29 112.921 170.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -56.96 -26.76 60.39 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 118.092 -1.443 . . . . 3.19 114.385 167.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.646 ' HG3' HD12 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.21 -40.51 96.2 Favored 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 115.371 -0.831 . . . . 1.81 111.003 173.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 102' ' ' ALA . 22.0 mt -53.51 -48.5 58.14 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.439 0 C-N-CA 116.036 -2.266 . . . . 0.09 110.08 168.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -54.53 45.66 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 116.668 2.099 . . . . 4.42 116.668 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.4 -28.06 68.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 123.478 1.609 . . . . 1.95 112.611 -176.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -92.28 -25.4 18.61 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 113.161 -1.836 . . . . 0.11 115.047 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -89.4 92.44 9.14 Favored 'General case' 0 C--N 1.338 0.085 0 O-C-N 126.729 2.518 . . . . 1.93 111.181 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.22 -32.26 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 123.125 1.441 . . . . 0.45 113.354 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -69.08 -30.96 69.39 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 112.832 -1.985 . . . . 1.15 113.632 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.14 63.46 2.66 Favored Glycine 0 C--N 1.345 1.065 0 C-N-CA 117.389 -2.339 . . . . 1.15 114.173 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -118.54 -12.17 9.82 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 113.294 -1.453 . . . . 2.49 113.586 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.17 22.3 38.61 Favored Glycine 0 C--N 1.35 1.347 0 N-CA-C 116.635 1.414 . . . . 0.31 116.635 -175.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -155.98 163.93 39.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.775 1.63 . . . . 1.71 108.267 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 128' ' ' ALA . 90.2 t -115.26 119.36 61.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 116.316 -2.153 . . . . 0.35 108.277 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -105.29 173.76 6.17 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 115.959 -2.297 . . . . 2.45 114.142 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -64.77 -36.56 84.71 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 124.274 1.988 . . . . 20.0 114.276 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.96 -45.5 94.48 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 111.351 -2.659 . . . . 2.9 110.51 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.502 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 64.4 mt-10 -64.63 -31.63 72.94 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-N 110.5 -3.046 . . . . 2.77 114.445 172.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 145' ' ' MET . 9.1 t80 -56.88 -40.7 76.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.953 1.835 . . . . 0.38 111.445 173.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.87 -46.45 88.54 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 CA-C-N 112.802 -1.999 . . . . 0.4 112.326 170.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -57.71 -33.97 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 114.333 1.234 . . . . 1.57 114.333 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.509 ' HE1' HD21 ' A' ' 105' ' ' LEU . 14.9 ttp -76.95 -48.04 19.22 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 123.796 1.76 . . . . 0.79 111.673 -178.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 141' ' ' PHE . 17.5 mmt -72.15 -56.86 4.86 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.53 -2.068 . . . . 0.36 112.452 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 17.4 m -60.31 -56.33 22.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 111.849 -2.432 . . . . 0.82 112.885 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 57.03 -163.63 0.17 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.396 -1.274 . . . . 1.28 112.031 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.344 0.333 0 CA-C-N 115.19 -0.914 . . . . 20.0 111.625 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 107.861 -1.162 . . . . 1.97 107.861 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HB2' ' HB3' ' A' ' 87' ' ' GLU . 2.1 pp20? -67.32 -33.44 75.26 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 126.223 2.202 . . . . 2.22 112.905 174.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.1 mm-40 -53.76 -54.18 41.76 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 125.231 2.443 . . . . 2.28 112.864 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.6 pt -73.38 -49.41 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 114.67 -2.812 . . . . 0.3 114.489 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -53.06 8.31 Favored 'General case' 0 C--O 1.206 -1.187 0 C-N-CA 118.327 -1.349 . . . . 2.72 113.892 -174.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HB3' ' HB2' ' A' ' 83' ' ' GLU . 16.6 tt0 -70.35 -35.53 73.63 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 114.654 1.353 . . . . 3.05 114.654 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -63.0 -39.22 94.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 113.434 -3.307 . . . . 0.07 109.981 166.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.598 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 84.8 t80 -56.17 -30.41 62.19 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.25 1.574 . . . . 0.11 115.25 169.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -37.64 77.92 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 115.683 -2.407 . . . . 4.69 110.553 176.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.1 t -65.1 -34.55 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 116.624 -2.03 . . . . 0.11 113.238 173.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.598 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.1 m-30 -61.23 -48.54 80.98 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 112.103 -2.317 . . . . 0.21 111.228 -178.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -76.42 76.61 3.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 125.034 2.35 . . . . 1.46 111.368 166.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -60.05 -30.09 68.97 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 111.213 -2.721 . . . . 3.98 115.314 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -85.4 -26.21 26.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 112.393 -2.185 . . . . 3.1 112.418 175.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.76 27.08 73.69 Favored Glycine 0 C--N 1.344 1.001 0 CA-C-N 113.223 -1.808 . . . . 0.46 111.685 178.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -68.19 -16.79 64.13 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 125.307 1.24 . . . . 1.31 114.188 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.67 -14.7 64.46 Favored Glycine 0 C--N 1.343 0.962 0 O-C-N 125.422 1.701 . . . . 0.23 113.743 -175.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -114.38 146.76 40.15 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.295 -1.453 . . . . 20.0 109.651 -173.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.9 mm -113.27 135.0 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.768 0 CA-C-N 112.669 -2.06 . . . . 0.31 110.078 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.0 t -107.4 159.72 16.18 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 116.242 -2.183 . . . . 0.21 108.511 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -46.19 -43.45 15.24 Favored 'General case' 0 CA--C 1.548 0.883 1 CA-C-O 128.513 4.006 . . . . 0.11 113.226 177.681 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -54.62 -46.83 73.95 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 110.717 -2.947 . . . . 0.12 115.201 174.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -28.15 69.73 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 115.356 1.613 . . . . 0.81 115.356 172.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.564 ' HG ' ' HB3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -54.64 -50.65 67.62 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 117.185 -1.806 . . . . 0.16 111.0 167.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -54.76 -28.52 49.21 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 117.358 -1.737 . . . . 3.52 115.256 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -62.86 -54.99 30.22 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 116.871 -1.932 . . . . 0.49 111.806 171.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.551 ' O ' HD23 ' A' ' 112' ' ' LEU . 2.7 m -57.68 -33.42 45.0 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 116.728 -1.989 . . . . 0.1 111.171 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.453 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 41.7 mmm -60.58 -44.52 96.11 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 123.292 1.52 . . . . 0.12 113.547 171.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.4 m -55.51 -45.18 77.14 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 113.62 -1.627 . . . . 0.18 112.384 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -59.24 -41.86 89.71 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 123.615 1.674 . . . . 1.12 112.826 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.551 HD23 ' O ' ' A' ' 108' ' ' VAL . 1.6 mm? -64.44 -7.5 10.15 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 112.688 -2.051 . . . . 0.45 112.363 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.8 -35.99 4.06 Favored Glycine 0 C--N 1.339 0.705 0 C-N-CA 117.835 -2.126 . . . . 0.41 110.796 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 109' ' ' MET . 33.2 mm-40 -108.5 111.07 22.75 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.574 -1.813 . . . . 2.29 110.645 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -93.32 130.12 39.18 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 113.932 -1.485 . . . . 1.51 111.056 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.463 ' HB3' ' CB ' ' A' ' 120' ' ' GLU . 4.4 mm? -95.02 153.16 17.77 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 116.375 -2.13 . . . . 3.77 109.82 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.536 ' O ' HG23 ' A' ' 121' ' ' VAL . 44.6 p -76.21 169.57 17.96 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 113.725 -1.579 . . . . 0.3 112.333 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -52.48 -33.92 46.83 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.702 1.371 . . . . 1.6 114.702 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -52.31 65.99 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 126.751 3.167 . . . . 1.75 111.125 176.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 124' ' ' MET . 12.2 mm-40 -61.73 -35.71 78.86 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 109.286 -3.597 . . . . 0.68 112.526 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.623 HG12 ' HB1' ' A' ' 102' ' ' ALA . 88.3 t -55.12 -36.33 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 123.5 1.619 . . . . 0.44 114.15 176.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.08 -44.9 78.88 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 112.415 -2.175 . . . . 1.29 111.628 172.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -57.4 -28.74 63.5 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 118.146 -1.421 . . . . 3.19 114.281 168.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.564 ' HB3' ' HG ' ' A' ' 105' ' ' LEU . 25.9 mmt -65.96 -37.03 84.94 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 115.253 -0.885 . . . . 1.81 110.709 178.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 14.3 mt -56.82 -50.23 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 116.151 -2.22 . . . . 0.09 109.736 168.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -37.73 73.79 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 116.029 1.863 . . . . 4.42 116.029 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -78.72 -32.1 46.71 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-O 124.709 2.195 . . . . 1.95 112.226 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -89.08 -26.6 21.29 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 112.705 -2.043 . . . . 0.11 114.092 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -86.53 91.27 8.5 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 126.612 2.445 . . . . 1.93 111.45 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.0 mp -95.5 -32.94 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-N 114.019 -1.446 . . . . 0.45 112.791 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -67.83 -33.44 74.78 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 113.253 -1.794 . . . . 1.15 113.73 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.09 64.57 2.28 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 118.179 -1.962 . . . . 1.15 113.419 -176.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -119.48 -10.95 9.56 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 113.705 -1.248 . . . . 2.49 113.595 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.39 22.72 39.57 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 116.616 1.406 . . . . 0.31 116.616 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -156.3 164.87 37.8 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.084 1.354 . . . . 1.71 107.668 -174.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.473 HG13 ' HB1' ' A' ' 128' ' ' ALA . 94.3 t -115.54 119.54 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 115.84 -2.344 . . . . 0.35 107.133 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -104.78 175.14 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 116.001 -2.28 . . . . 2.45 114.969 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.68 -35.2 80.27 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 123.279 1.514 . . . . 20.0 113.899 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -62.94 -46.75 86.28 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 111.962 -2.381 . . . . 2.9 110.466 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 60.8 mt-10 -60.44 -31.07 70.07 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 110.394 -3.094 . . . . 2.77 114.854 171.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.96 -41.16 74.3 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 124.204 1.955 . . . . 0.38 112.195 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.7 t -69.13 -49.69 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 112.239 -2.255 . . . . 0.4 112.109 171.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.414 ' HB3' ' HA ' ' A' ' 140' ' ' GLU . 12.5 tp60 -56.06 -27.35 53.04 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 114.205 -1.362 . . . . 1.57 114.671 -178.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -53.3 8.66 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 124.155 1.931 . . . . 0.79 110.899 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 33.0 mtt -76.47 -54.29 6.93 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 114.614 -2.834 . . . . 0.36 114.731 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 23.3 m -57.08 -59.74 4.63 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.345 -1.752 . . . . 0.82 112.686 173.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 52.66 -159.09 0.13 Allowed 'General case' 0 C--N 1.345 0.376 0 O-C-N 124.884 1.365 . . . . 1.28 111.47 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt . . . . . 0 C--N 1.347 0.49 0 CA-C-O 118.462 -0.78 . . . . 20.0 111.052 175.074 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 . . . . . 0 CA--C 1.502 -0.897 0 N-CA-C 106.95 -1.5 . . . . 1.97 106.95 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -37.13 47.88 Favored 'General case' 0 C--O 1.218 -0.571 0 O-C-N 125.895 1.997 . . . . 2.22 114.013 168.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -50.63 -59.74 3.75 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 123.943 1.83 . . . . 2.28 111.778 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.9 pt -73.02 -49.25 40.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 116.242 -2.183 . . . . 0.3 115.481 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.43 -55.05 7.66 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 113.269 -1.787 . . . . 2.72 113.948 -175.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -70.12 -35.27 73.99 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 117.9 -1.52 . . . . 3.05 113.807 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.69 92.9 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 113.974 -3.091 . . . . 0.07 109.305 170.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.55 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 76.4 t80 -56.45 -32.09 64.6 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 114.998 1.481 . . . . 0.11 114.998 168.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -65.96 -36.88 84.54 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 115.6 -2.44 . . . . 4.69 113.521 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.1 t -70.26 -28.41 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 117.809 -1.556 . . . . 0.11 113.058 171.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.55 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.8 m-30 -63.03 -49.98 72.5 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 113.067 -1.879 . . . . 0.21 111.571 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -76.5 79.32 3.2 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 126.959 2.662 . . . . 1.46 109.796 167.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -58.19 -30.46 66.47 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 111.435 -2.621 . . . . 3.98 113.879 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.418 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 21.3 p-10 -91.48 -17.39 25.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 113.525 -1.671 . . . . 3.1 113.756 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.66 20.47 79.63 Favored Glycine 0 C--N 1.343 0.931 0 C-N-CA 117.486 -2.292 . . . . 0.46 112.828 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.448 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.66 -9.22 12.78 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 116.321 1.971 . . . . 1.31 116.321 -178.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.448 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 91.18 -31.3 5.75 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 124.821 1.326 . . . . 0.23 115.056 -171.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.425 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 41.3 m-85 -110.81 145.87 37.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 112.806 -1.697 . . . . 20.0 112.651 -172.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' A' ' 104' ' ' GLU . 13.6 mm -102.88 133.84 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-N 112.146 -2.297 . . . . 0.31 110.01 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.9 t -107.23 159.12 16.59 Favored 'General case' 0 CA--C 1.503 -0.832 0 C-N-CA 115.197 -2.601 . . . . 0.21 108.017 170.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.445 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -47.53 -42.47 23.39 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 127.927 3.727 . . . . 0.11 112.141 178.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.07 87.42 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-N 111.593 -2.549 . . . . 0.12 115.174 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.579 ' OE1' HD13 ' A' ' 100' ' ' ILE . 4.4 tt0 -66.26 -25.46 66.89 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 114.986 1.476 . . . . 0.81 114.986 171.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.648 HD13 HG22 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -56.33 -45.83 80.16 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 116.293 -2.163 . . . . 0.16 111.306 167.298 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 -55.8 -28.22 55.11 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.176 1.941 . . . . 3.52 115.327 171.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.401 ' O ' ' HB ' ' A' ' 110' ' ' THR . 55.7 t60 -65.1 -52.2 56.86 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 116.313 -2.155 . . . . 0.49 112.008 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.648 HG22 HD13 ' A' ' 105' ' ' LEU . 1.2 m -55.65 -36.68 43.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.834 0 C-N-CA 116.233 -2.187 . . . . 0.1 111.612 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.51 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 50.0 mmm -60.24 -44.54 95.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 125.211 2.434 . . . . 0.12 113.581 173.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 107' ' ' HIS . 80.8 m -51.1 -47.01 62.02 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 112.815 -1.993 . . . . 0.18 113.053 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.41 -39.24 90.05 Favored 'General case' 0 C--O 1.216 -0.661 0 O-C-N 125.837 1.96 . . . . 1.12 113.443 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.481 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.6 mm? -67.08 -7.96 26.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 123.38 1.562 . . . . 0.45 112.274 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 97.78 -37.92 3.29 Favored Glycine 0 C--N 1.342 0.865 0 C-N-CA 118.514 -1.803 . . . . 0.41 110.8 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.51 ' O ' ' HB3' ' A' ' 109' ' ' MET . 74.4 mm-40 -105.79 116.12 31.4 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-N 112.196 -2.002 . . . . 2.29 109.363 -173.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -94.41 128.91 41.25 Favored 'General case' 0 CA--C 1.502 -0.89 0 C-N-CA 115.718 -2.393 . . . . 1.51 111.239 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' A' ' 124' ' ' MET . 39.3 mt -93.2 157.89 16.04 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 116.193 -2.203 . . . . 3.77 109.949 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.6 p -81.02 175.09 10.99 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 117.312 -1.755 . . . . 0.3 111.406 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -58.44 -29.97 66.55 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 114.725 1.38 . . . . 1.6 114.725 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.72 -50.98 71.73 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-O 124.991 2.329 . . . . 1.75 111.095 175.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.48 ' O ' ' SD ' ' A' ' 124' ' ' MET . 17.6 mm-40 -63.51 -43.23 97.82 Favored 'General case' 0 C--O 1.207 -1.174 0 CA-C-N 109.716 -3.402 . . . . 0.68 110.693 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.604 ' O ' ' HB2' ' A' ' 124' ' ' MET . 72.6 t -51.51 -34.7 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 124.468 2.08 . . . . 0.44 115.022 174.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -65.35 -45.6 83.54 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 116.402 -2.119 . . . . 1.29 112.021 170.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -56.06 -29.09 60.0 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.262 -1.375 . . . . 3.19 114.008 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.604 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -63.07 -39.35 94.45 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 112.06 0.393 . . . . 1.81 112.06 174.399 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 24.2 mt -53.91 -48.95 62.32 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.573 0 C-N-CA 115.6 -2.44 . . . . 0.09 109.636 169.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -57.23 13.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 117.949 2.574 . . . . 4.42 117.949 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.92 -29.15 70.07 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.97 1.366 . . . . 1.95 112.191 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.542 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -91.2 -23.86 20.09 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 113.411 -1.722 . . . . 0.11 115.176 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -90.58 92.5 8.88 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 126.092 2.12 . . . . 1.93 111.743 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.443 HG21 ' HG2' ' A' ' 143' ' ' GLN . 3.8 mp -94.08 -34.32 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 123.355 1.55 . . . . 0.45 113.441 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -67.6 -31.61 71.77 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 113.448 -1.705 . . . . 1.15 113.291 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.47 64.71 2.32 Favored Glycine 0 C--N 1.343 0.921 0 C-N-CA 117.583 -2.246 . . . . 1.15 114.101 -176.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -119.7 -10.39 9.58 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 125.259 1.211 . . . . 2.49 113.731 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 21.52 47.07 Favored Glycine 0 C--N 1.354 1.547 0 N-CA-C 116.962 1.545 . . . . 0.31 116.962 -174.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -155.22 164.25 39.07 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.04 1.736 . . . . 1.71 108.564 -175.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.542 HG13 ' HB1' ' A' ' 128' ' ' ALA . 97.4 t -115.31 121.68 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 C-N-CA 116.629 -2.029 . . . . 0.35 107.883 -178.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -109.26 173.88 6.12 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 115.26 -2.576 . . . . 2.45 114.477 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -64.63 -35.38 80.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 123.998 1.856 . . . . 20.0 114.441 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -62.78 -44.68 95.53 Favored 'General case' 0 CA--C 1.492 -1.273 0 CA-C-N 111.69 -2.504 . . . . 2.9 110.311 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.512 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 70.3 mt-10 -62.66 -30.65 71.54 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 110.971 -2.831 . . . . 2.77 114.023 172.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -58.02 -37.53 74.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 124.494 2.093 . . . . 0.38 112.749 171.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.99 -49.71 54.08 Favored 'Isoleucine or valine' 0 C--N 1.345 0.397 0 CA-C-N 112.277 -2.238 . . . . 0.4 112.363 169.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.443 ' HG2' HG21 ' A' ' 130' ' ' ILE . 0.4 OUTLIER -58.06 -26.71 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.616 1.339 . . . . 1.57 114.616 -177.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.0 ttp -77.11 -49.74 14.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 122.993 1.377 . . . . 0.79 111.657 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 mtt -77.22 -52.4 9.29 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 115.883 -2.327 . . . . 0.36 114.627 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.3 m -57.72 -53.38 58.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 113.117 -1.856 . . . . 0.82 112.736 174.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.62 -168.7 0.1 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 125.342 1.651 . . . . 1.28 111.911 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? . . . . . 0 C--N 1.348 0.519 0 CA-C-N 115.498 -0.774 . . . . 20.0 112.138 -177.517 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 CA--C 1.48 -1.744 0 CA-C-O 119.614 -0.232 . . . . 1.97 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -65.22 -35.69 81.84 Favored 'General case' 0 C--O 1.217 -0.655 0 O-C-N 126.337 2.273 . . . . 2.22 112.268 171.417 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 5.8 mm-40 -53.83 -55.33 27.62 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 126.056 2.836 . . . . 2.28 112.295 -176.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.4 pt -72.21 -52.18 25.81 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 111.214 -2.721 . . . . 0.3 114.288 175.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -75.19 -54.99 6.18 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 117.301 -1.76 . . . . 2.72 114.206 -174.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 83' ' ' GLU . 21.1 tt0 -67.11 -34.69 78.14 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 117.962 -1.495 . . . . 3.05 114.882 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.7 -40.83 98.35 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 112.781 -3.568 . . . . 0.07 109.918 168.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.622 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 83.2 t80 -53.95 -31.55 50.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.744 1.757 . . . . 0.11 115.744 168.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -67.75 -36.93 81.43 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 117.651 -1.62 . . . . 4.69 112.618 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.57 -33.21 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 118.004 -1.478 . . . . 0.11 112.618 170.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.622 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.3 m-30 -59.95 -49.92 75.78 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 112.731 -2.031 . . . . 0.21 110.99 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -78.27 78.17 4.75 Favored 'General case' 0 CA--C 1.509 -0.619 0 O-C-N 125.813 1.946 . . . . 1.46 110.203 170.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -57.76 -29.68 65.01 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 112.361 -2.2 . . . . 3.98 114.605 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.419 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 19.9 p30 -89.15 -18.06 27.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 112.646 -2.07 . . . . 3.1 114.229 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 71.68 17.43 76.59 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 117.575 -2.25 . . . . 0.46 112.849 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.47 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -65.28 -8.86 19.86 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 115.813 1.783 . . . . 1.31 115.813 -177.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.47 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 88.74 -29.32 5.89 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 116.121 1.209 . . . . 0.23 116.121 -173.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.412 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 42.8 m-85 -110.43 146.79 35.27 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 113.4 -1.4 . . . . 20.0 111.79 -175.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.403 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 32.4 mm -114.95 132.18 64.95 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 CA-C-N 112.225 -2.261 . . . . 0.31 110.231 -177.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -103.78 167.99 9.43 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 113.856 -3.137 . . . . 0.21 110.907 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.751 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -48.63 -42.65 34.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 127.528 3.537 . . . . 0.11 113.225 175.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -51.84 -41.7 62.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.572 -2.558 . . . . 0.12 115.284 174.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.546 ' O ' HG13 ' A' ' 108' ' ' VAL . 2.5 mt-10 -76.8 -28.79 55.74 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 113.618 -1.628 . . . . 0.81 114.927 173.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.575 HD23 HG11 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -56.05 -29.03 59.87 Favored 'General case' 0 C--O 1.221 -0.419 0 O-C-N 124.91 1.381 . . . . 0.16 111.956 168.669 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.95 ' NH2' ' OD1' ' A' ' 118' ' ' ASP . 35.1 ttm-85 -74.25 -34.24 63.55 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 114.296 -1.32 . . . . 3.52 113.244 171.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.497 ' O ' ' HB ' ' A' ' 110' ' ' THR . 12.3 t-160 -61.37 -46.47 90.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 116.421 -2.112 . . . . 0.49 111.006 172.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 105' ' ' LEU . 1.1 m -59.19 -38.52 74.81 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 113.74 -1.573 . . . . 0.1 110.814 175.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.495 ' SD ' ' HG ' ' A' ' 116' ' ' LEU . 2.0 mmt -58.18 -40.5 81.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 124.616 2.151 . . . . 0.12 114.493 173.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.54 HG23 ' HE3' ' A' ' 115' ' ' LYS . 52.8 m -52.98 -47.44 68.2 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 113.056 -1.884 . . . . 0.18 112.733 171.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -62.08 -38.01 87.18 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 126.958 2.661 . . . . 1.12 114.028 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.73 -14.46 52.58 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 113.355 -1.748 . . . . 0.45 111.937 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.11 -36.95 3.91 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 118.176 -1.964 . . . . 0.41 110.825 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 109' ' ' MET . 1.4 mt-10 -106.65 110.12 22.22 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 112.717 -1.741 . . . . 2.29 109.377 -173.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.54 ' HE3' HG23 ' A' ' 110' ' ' THR . 33.8 mttp -94.44 119.95 33.93 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 116.153 -2.219 . . . . 1.51 110.036 177.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.495 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 14.0 mt -95.53 161.0 14.24 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 114.424 -2.91 . . . . 3.77 109.893 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.5 p -76.39 176.98 7.7 Favored 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 117.378 -1.729 . . . . 0.3 111.751 -174.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.95 ' OD1' ' NH2' ' A' ' 106' ' ' ARG . 1.5 m-20 -50.8 -39.19 52.19 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 115.061 1.504 . . . . 1.6 115.061 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.76 -54.05 39.38 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-O 125.928 2.775 . . . . 1.75 110.493 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.68 -33.83 76.52 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 109.724 -3.398 . . . . 0.68 113.343 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.751 HG12 ' HB1' ' A' ' 102' ' ' ALA . 94.3 t -56.09 -35.67 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 123.517 1.627 . . . . 0.44 114.694 171.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -64.3 -44.22 92.31 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 112.306 -2.225 . . . . 1.29 111.804 170.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.68 -29.3 66.52 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 117.317 -1.753 . . . . 3.19 114.077 168.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.441 ' SD ' ' HA ' ' A' ' 121' ' ' VAL . 39.4 mtt -68.76 -32.27 71.9 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 117.857 -1.068 . . . . 1.81 112.176 176.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 102' ' ' ALA . 37.8 mt -55.99 -51.02 65.98 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 117.132 -1.827 . . . . 0.09 108.666 166.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.593 ' C ' HH11 ' A' ' 126' ' ' ARG . 0.0 OUTLIER -54.6 -60.78 2.88 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 116.653 -2.019 . . . . 4.42 113.825 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.42 ' HA ' ' NH1' ' A' ' 126' ' ' ARG . 6.7 tp10 -61.76 -25.71 67.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.482 2.087 . . . . 1.95 113.726 -174.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.535 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -91.54 -23.19 20.0 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 113.001 -1.909 . . . . 0.11 115.381 176.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -92.27 93.39 8.63 Favored 'General case' 0 CA--C 1.523 -0.09 0 O-C-N 126.12 2.138 . . . . 1.93 110.096 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.3 mp -95.66 -34.47 5.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 114.392 -1.276 . . . . 0.45 113.245 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -66.64 -31.15 71.66 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 113.185 -1.825 . . . . 1.15 113.3 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.45 64.75 2.41 Favored Glycine 0 C--N 1.344 0.982 0 C-N-CA 117.996 -2.049 . . . . 1.15 113.6 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 p-10 -118.44 -12.2 9.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.254 -0.973 . . . . 2.49 113.611 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.83 19.27 48.34 Favored Glycine 0 C--N 1.355 1.614 0 N-CA-C 117.018 1.567 . . . . 0.31 117.018 -174.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -152.7 165.09 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.864 1.666 . . . . 1.71 108.477 -175.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.575 HG11 HD23 ' A' ' 105' ' ' LEU . 84.4 t -114.43 122.0 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 O-C-N 126.181 2.176 . . . . 0.35 108.349 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -109.59 174.51 5.83 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 114.239 -2.985 . . . . 2.45 112.581 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.433 ' HD2' ' OE2' ' A' ' 139' ' ' GLU . 34.3 t80 -65.51 -36.9 85.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.425 1.583 . . . . 20.0 113.875 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.433 ' OE2' ' HD2' ' A' ' 138' ' ' TYR . 12.7 mm-40 -62.56 -46.07 90.03 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 111.83 -2.441 . . . . 2.9 109.94 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.534 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 71.3 mt-10 -63.21 -30.64 71.74 Favored 'General case' 0 CA--C 1.501 -0.921 0 CA-C-N 111.252 -2.704 . . . . 2.77 114.468 172.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.55 ' O ' ' HG3' ' A' ' 145' ' ' MET . 10.0 t80 -58.68 -38.07 77.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 124.195 1.95 . . . . 0.38 111.954 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 139' ' ' GLU . 86.8 t -69.32 -47.55 72.72 Favored 'Isoleucine or valine' 0 C--N 1.344 0.365 0 CA-C-N 112.928 -1.942 . . . . 0.4 111.182 171.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.21 -30.53 64.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.522 1.304 . . . . 1.57 114.522 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.1 ttp -77.78 -46.52 21.4 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 123.792 1.758 . . . . 0.79 111.379 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 141' ' ' PHE . 2.0 mtt -76.83 -52.34 9.68 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 115.833 -2.347 . . . . 0.36 113.467 -179.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.5 m -58.79 -52.04 67.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 112.274 -2.239 . . . . 0.82 112.834 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.68 -162.41 0.18 Allowed 'General case' 0 C--O 1.233 0.223 0 O-C-N 125.064 1.477 . . . . 1.28 111.128 -178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 12.5 tptt . . . . . 0 C--N 1.344 0.345 0 CA-C-O 118.334 -0.841 . . . . 20.0 111.51 179.827 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 . . . . . 0 CA--C 1.492 -1.271 0 N-CA-C 108.237 -1.023 . . . . 1.97 108.237 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -65.73 -33.59 76.24 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 125.909 2.006 . . . . 2.22 113.957 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 48.8 mm-40 -52.75 -55.82 20.05 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-O 125.955 2.788 . . . . 2.28 112.068 -178.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 20.1 pt -73.92 -48.73 37.65 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 CA-C-N 111.272 -2.695 . . . . 0.3 114.461 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -76.46 -55.57 5.42 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 117.764 -1.574 . . . . 2.72 113.894 -174.731 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -63.91 -41.1 97.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.149 -1.387 . . . . 3.05 112.862 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.42 -37.97 87.89 Favored 'General case' 0 C--O 1.213 -0.866 0 C-N-CA 113.009 -3.477 . . . . 0.07 110.04 172.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.588 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.7 t80 -54.71 -30.32 55.63 Favored 'General case' 0 C--N 1.349 0.567 0 N-CA-C 116.053 1.871 . . . . 0.11 116.053 167.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -67.88 -39.69 83.64 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 117.585 -1.646 . . . . 4.69 111.894 174.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 27.4 t -67.71 -29.88 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 118.192 -1.403 . . . . 0.11 112.926 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.588 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -63.03 -50.92 68.78 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 113.372 -1.74 . . . . 0.21 110.358 -178.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -80.58 79.09 7.25 Favored 'General case' 0 CA--C 1.51 -0.564 0 O-C-N 126.303 2.252 . . . . 1.46 110.716 168.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -55.71 -33.69 64.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 111.12 -2.764 . . . . 3.98 114.317 -174.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.427 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 22.8 p-10 -90.11 -17.89 26.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 112.781 -2.008 . . . . 3.1 113.231 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.97 23.46 77.02 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 117.701 -2.19 . . . . 0.46 111.939 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.469 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.92 -9.74 17.12 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 115.469 1.655 . . . . 1.31 115.469 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.469 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 87.19 -26.69 6.68 Favored Glycine 0 C--N 1.348 1.239 0 N-CA-C 116.413 1.325 . . . . 0.23 116.413 -171.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.427 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 41.9 m-85 -110.56 145.19 38.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 123.351 1.548 . . . . 20.0 111.845 -176.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.435 HD11 ' CE1' ' A' ' 89' ' ' PHE . 27.6 mm -105.43 131.53 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-N 112.482 -2.145 . . . . 0.31 110.068 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -101.75 162.21 13.07 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 113.982 -3.087 . . . . 0.21 109.762 170.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.514 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -49.26 -42.91 42.3 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 127.453 3.502 . . . . 0.11 112.246 173.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -55.97 -37.22 68.75 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 111.891 -2.413 . . . . 0.12 114.641 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.455 ' O ' HG13 ' A' ' 108' ' ' VAL . 2.5 tt0 -74.74 -29.26 61.1 Favored 'General case' 0 CA--C 1.495 -1.173 0 CA-C-N 113.638 -1.619 . . . . 0.81 114.146 174.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.673 HD21 ' HE1' ' A' ' 144' ' ' MET . 0.2 OUTLIER -53.88 -52.62 59.88 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 117.283 -1.767 . . . . 0.16 109.398 170.559 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.431 ' HE ' HG21 ' A' ' 121' ' ' VAL . 22.7 ttp85 -52.91 -32.64 46.42 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 115.255 1.576 . . . . 3.52 115.255 173.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -59.29 -54.15 50.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 116.769 -1.973 . . . . 0.49 112.805 170.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' HD23 ' A' ' 112' ' ' LEU . 0.9 OUTLIER -55.45 -35.3 37.04 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 125.33 1.644 . . . . 0.1 111.54 176.549 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.517 ' HB3' ' O ' ' A' ' 114' ' ' GLU . 35.8 mmm -64.01 -41.71 97.37 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 123.461 1.601 . . . . 0.12 113.161 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.409 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 85.3 m -57.1 -43.34 82.15 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 113.617 -1.629 . . . . 0.18 112.872 171.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -60.72 -38.85 86.45 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 123.821 1.772 . . . . 1.12 113.207 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 108' ' ' VAL . 3.2 mm? -68.46 -8.24 39.09 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 112.402 -2.181 . . . . 0.45 112.254 179.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.43 -40.24 2.53 Favored Glycine 0 C--N 1.342 0.906 0 C-N-CA 118.229 -1.939 . . . . 0.41 110.854 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.517 ' O ' ' HB3' ' A' ' 109' ' ' MET . 20.0 mm-40 -97.6 117.71 32.49 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-N 112.451 -1.874 . . . . 2.29 111.524 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 48.3 mtpt -109.96 116.03 30.87 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 117.62 -1.632 . . . . 1.51 110.657 -176.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.6 mp -95.84 152.51 18.43 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 116.098 -2.241 . . . . 3.77 109.187 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.504 ' O ' HG23 ' A' ' 121' ' ' VAL . 81.2 p -74.76 175.91 7.52 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 117.764 -1.574 . . . . 0.3 112.641 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.46 ' O ' ' HB ' ' A' ' 121' ' ' VAL . 56.0 m-20 -50.82 -37.8 45.02 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 115.017 1.488 . . . . 1.6 115.017 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -54.62 -48.7 71.91 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-O 124.536 2.112 . . . . 1.75 112.54 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.418 ' O ' ' SD ' ' A' ' 124' ' ' MET . 6.4 mm-40 -70.16 -39.05 75.54 Favored 'General case' 0 C--O 1.206 -1.21 0 CA-C-N 110.629 -2.987 . . . . 0.68 111.073 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.599 ' O ' ' HB2' ' A' ' 124' ' ' MET . 80.1 t -51.82 -35.24 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 124.13 1.919 . . . . 0.44 114.556 173.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.84 -44.37 90.01 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.073 -2.251 . . . . 1.29 112.818 169.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -56.92 -28.07 61.6 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 118.475 -1.29 . . . . 3.19 114.149 168.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.599 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -62.63 -42.36 99.55 Favored 'General case' 0 CA--C 1.484 -1.588 0 CA-C-O 117.34 -1.314 . . . . 1.81 111.023 172.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.461 ' CG1' ' HB2' ' A' ' 102' ' ' ALA . 17.1 mt -53.92 -46.23 64.27 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.583 0 C-N-CA 116.879 -1.929 . . . . 0.09 110.217 170.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -57.39 13.24 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 115.496 -2.482 . . . . 4.42 116.032 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -65.31 -27.5 68.65 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 124.835 2.255 . . . . 1.95 113.602 -176.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -90.45 -25.99 20.06 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 112.399 -2.182 . . . . 0.11 114.402 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -89.59 90.83 8.43 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 126.814 2.571 . . . . 1.93 111.333 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.6 mp -94.66 -33.74 5.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 122.645 1.212 . . . . 0.45 113.293 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.0 p30 -66.36 -32.6 74.09 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 113.243 -1.798 . . . . 1.15 113.012 174.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.56 65.06 2.14 Favored Glycine 0 C--N 1.345 1.038 0 C-N-CA 116.868 -2.587 . . . . 1.15 113.677 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -119.94 -11.02 9.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 113.253 -1.473 . . . . 2.49 113.68 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.38 19.78 51.14 Favored Glycine 0 C--N 1.354 1.534 0 N-CA-C 116.549 1.38 . . . . 0.31 116.549 -174.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -154.13 162.9 40.88 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.007 1.723 . . . . 1.71 107.81 -173.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.437 HG13 ' HB1' ' A' ' 128' ' ' ALA . 97.3 t -113.96 119.85 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.676 0 C-N-CA 115.251 -2.579 . . . . 0.35 107.218 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -106.71 179.97 4.11 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 114.111 -3.036 . . . . 2.45 114.293 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -68.41 -33.86 74.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 124.185 1.945 . . . . 20.0 114.353 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -61.66 -47.63 84.5 Favored 'General case' 0 CA--C 1.492 -1.282 0 CA-C-N 110.634 -2.985 . . . . 2.9 110.162 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.549 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 80.8 mt-10 -63.38 -30.78 71.85 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-N 111.308 -2.678 . . . . 2.77 114.178 172.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -56.62 -39.21 73.22 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 124.285 1.993 . . . . 0.38 112.458 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.38 -47.63 76.73 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 CA-C-N 111.995 -2.366 . . . . 0.4 111.908 170.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -60.9 -26.61 67.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.903 1.446 . . . . 1.57 114.903 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.673 ' HE1' HD21 ' A' ' 105' ' ' LEU . 4.7 ttm -74.42 -53.46 9.52 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 124.958 2.314 . . . . 0.79 110.587 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 28.1 mtt -76.66 -50.84 12.74 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 115.823 -2.351 . . . . 0.36 114.143 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.0 m -60.78 -56.53 20.16 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 112.937 -1.938 . . . . 0.82 112.37 176.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.25 -167.21 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 O-C-N 124.842 1.339 . . . . 1.28 112.101 -177.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 10.2 tptt . . . . . 0 C--N 1.346 0.431 0 CA-C-O 118.175 -0.917 . . . . 20.0 112.12 -179.41 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' HLT . . . . . 0.408 ' F2 ' ' SD ' ' A' ' 144' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 CA--C 1.496 -1.102 0 CA-C-O 117.785 -1.102 . . . . 1.97 108.132 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.59 -33.03 74.97 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 125.743 1.902 . . . . 2.22 114.118 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.2 mm-40 -53.59 -56.9 13.19 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 126.24 2.924 . . . . 2.28 112.182 -178.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.7 pt -72.16 -50.33 37.34 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.636 0 CA-C-N 111.256 -2.702 . . . . 0.3 114.207 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -73.55 -56.67 4.72 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.053 -1.43 . . . . 2.72 113.897 -174.302 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.02 -37.29 81.22 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 113.846 -1.525 . . . . 3.05 113.851 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.67 -38.32 89.86 Favored 'General case' 0 C--O 1.213 -0.831 0 C-N-CA 113.277 -3.369 . . . . 0.07 109.702 169.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 79.8 t80 -56.91 -29.76 63.33 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 115.643 1.72 . . . . 0.11 115.643 168.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -67.81 -39.49 83.95 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 117.344 -1.742 . . . . 4.69 112.035 176.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.75 -32.82 58.32 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 114.057 -1.429 . . . . 0.11 111.991 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.597 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.7 m-30 -60.52 -49.25 78.32 Favored 'General case' 0 CA--C 1.497 -1.078 0 O-C-N 125.745 1.903 . . . . 0.21 111.635 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -78.99 80.28 5.34 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-O 124.325 2.012 . . . . 1.46 109.681 169.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -56.82 -30.56 63.87 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 111.409 -2.632 . . . . 3.98 113.568 -171.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.405 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 13.5 p30 -90.43 -18.33 25.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 113.095 -1.866 . . . . 3.1 113.896 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.17 15.89 76.81 Favored Glycine 0 C--N 1.343 0.927 0 C-N-CA 116.802 -2.618 . . . . 0.46 113.103 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.479 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -64.92 -10.5 29.37 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.011 1.856 . . . . 1.31 116.011 -177.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.479 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 90.59 -29.07 7.0 Favored Glycine 0 C--N 1.347 1.178 0 N-CA-C 116.113 1.205 . . . . 0.23 116.113 -172.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -110.07 146.35 35.54 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 113.581 -1.309 . . . . 20.0 111.696 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 37.9 mm -109.26 130.47 62.21 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 CA-C-N 112.641 -2.072 . . . . 0.31 110.881 -179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 t -101.43 163.21 12.39 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 114.486 -2.885 . . . . 0.21 108.955 171.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.467 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -50.43 -42.5 54.08 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 127.825 3.678 . . . . 0.11 112.11 176.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -53.58 -37.7 63.21 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.604 -2.544 . . . . 0.12 114.778 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.533 ' O ' HG13 ' A' ' 108' ' ' VAL . 1.7 mt-10 -74.69 -30.52 61.59 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 115.512 1.671 . . . . 0.81 115.512 172.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.646 HD12 ' HG3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -55.65 -35.85 66.4 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 115.825 -2.35 . . . . 0.16 111.673 170.433 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.401 ' NH1' ' OD1' ' A' ' 118' ' ' ASP . 64.4 ttt180 -67.83 -30.47 69.88 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 113.957 -1.474 . . . . 3.52 113.913 172.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.408 ' O ' ' HB ' ' A' ' 110' ' ' THR . 22.4 t60 -62.32 -50.3 72.18 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 116.979 -1.888 . . . . 0.49 111.142 171.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.569 HG12 ' HB3' ' A' ' 92' ' ' PHE . 0.9 OUTLIER -55.42 -40.59 58.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 CA-C-N 113.623 -1.626 . . . . 0.1 110.687 177.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.512 ' SD ' HD23 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -60.41 -39.71 88.37 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 125.633 2.635 . . . . 0.12 113.466 174.423 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 107' ' ' HIS . 19.9 m -53.83 -47.99 70.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 112.871 -1.968 . . . . 0.18 113.413 171.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -61.91 -37.23 83.86 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 126.559 2.412 . . . . 1.12 112.96 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.9 mm? -63.55 -11.59 25.68 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 113.874 -1.512 . . . . 0.45 111.781 176.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.05 -34.83 4.94 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 118.637 -1.744 . . . . 0.41 110.36 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 109' ' ' MET . 23.7 mt-10 -108.23 108.45 19.49 Favored 'General case' 0 C--O 1.215 -0.741 0 CA-C-N 112.888 -1.656 . . . . 2.29 109.093 -173.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -89.34 135.52 33.54 Favored 'General case' 0 CA--C 1.498 -1.026 0 C-N-CA 116.44 -2.104 . . . . 1.51 110.895 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.512 HD23 ' SD ' ' A' ' 109' ' ' MET . 1.3 mm? -101.4 155.67 17.92 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 126.534 2.396 . . . . 3.77 109.582 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.533 ' O ' HG23 ' A' ' 121' ' ' VAL . 74.0 p -78.14 170.25 16.92 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 116.592 -2.043 . . . . 0.3 112.044 -173.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.401 ' OD1' ' NH1' ' A' ' 106' ' ' ARG . 50.1 m-20 -55.04 -31.72 61.31 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 114.662 1.356 . . . . 1.6 114.662 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.42 -48.42 81.72 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 125.268 2.461 . . . . 1.75 112.018 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.486 ' O ' ' SD ' ' A' ' 124' ' ' MET . 48.5 mm-40 -67.01 -39.06 86.98 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 109.543 -3.48 . . . . 0.68 111.472 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.642 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.1 t -53.34 -33.87 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 124.371 2.034 . . . . 0.44 114.021 174.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -68.54 -41.81 79.31 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 115.938 -2.305 . . . . 1.29 112.921 170.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -56.96 -26.76 60.39 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 118.092 -1.443 . . . . 3.19 114.385 167.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.646 ' HG3' HD12 ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.21 -40.51 96.2 Favored 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 115.371 -0.831 . . . . 1.81 111.003 173.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 102' ' ' ALA . 22.0 mt -53.51 -48.5 58.14 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.439 0 C-N-CA 116.036 -2.266 . . . . 0.09 110.08 168.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -54.53 45.66 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 116.668 2.099 . . . . 4.42 116.668 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.4 -28.06 68.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 123.478 1.609 . . . . 1.95 112.611 -176.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -92.28 -25.4 18.61 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 113.161 -1.836 . . . . 0.11 115.047 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -89.4 92.44 9.14 Favored 'General case' 0 C--N 1.338 0.085 0 O-C-N 126.729 2.518 . . . . 1.93 111.181 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.22 -32.26 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 123.125 1.441 . . . . 0.45 113.354 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -69.08 -30.96 69.39 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 112.832 -1.985 . . . . 1.15 113.632 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.14 63.46 2.66 Favored Glycine 0 C--N 1.345 1.065 0 C-N-CA 117.389 -2.339 . . . . 1.15 114.173 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -118.54 -12.17 9.82 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 113.294 -1.453 . . . . 2.49 113.586 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.17 22.3 38.61 Favored Glycine 0 C--N 1.35 1.347 0 N-CA-C 116.635 1.414 . . . . 0.31 116.635 -175.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -155.98 163.93 39.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.775 1.63 . . . . 1.71 108.267 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 128' ' ' ALA . 90.2 t -115.26 119.36 61.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 116.316 -2.153 . . . . 0.35 108.277 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -105.29 173.76 6.17 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 115.959 -2.297 . . . . 2.45 114.142 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -64.77 -36.56 84.71 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 124.274 1.988 . . . . 20.0 114.276 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.96 -45.5 94.48 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 111.351 -2.659 . . . . 2.9 110.51 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.502 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 64.4 mt-10 -64.63 -31.63 72.94 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-N 110.5 -3.046 . . . . 2.77 114.445 172.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 145' ' ' MET . 9.1 t80 -56.88 -40.7 76.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.953 1.835 . . . . 0.38 111.445 173.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.87 -46.45 88.54 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 CA-C-N 112.802 -1.999 . . . . 0.4 112.326 170.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -57.71 -33.97 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 114.333 1.234 . . . . 1.57 114.333 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.941 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 14.9 ttp -76.95 -48.04 19.22 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 123.796 1.76 . . . . 0.79 111.673 -178.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.859 ' HE1' 'BR ' ' A' ' 150' ' ' HLT . 17.5 mmt -72.15 -56.86 4.86 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 116.53 -2.068 . . . . 0.36 112.452 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 17.4 m -60.31 -56.33 22.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 111.849 -2.432 . . . . 0.82 112.885 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 57.03 -163.63 0.17 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.396 -1.274 . . . . 1.28 112.031 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.344 0.333 0 CA-C-N 115.19 -0.914 . . . . 20.0 111.625 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' HLT . . . . . 0.941 'BR ' ' SD ' ' A' ' 144' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 107.861 -1.162 . . . . 1.97 107.861 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HB2' ' HB3' ' A' ' 87' ' ' GLU . 2.1 pp20? -67.32 -33.44 75.26 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 126.223 2.202 . . . . 2.22 112.905 174.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 6.1 mm-40 -53.76 -54.18 41.76 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 125.231 2.443 . . . . 2.28 112.864 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.6 pt -73.38 -49.41 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 114.67 -2.812 . . . . 0.3 114.489 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -53.06 8.31 Favored 'General case' 0 C--O 1.206 -1.187 0 C-N-CA 118.327 -1.349 . . . . 2.72 113.892 -174.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HB3' ' HB2' ' A' ' 83' ' ' GLU . 16.6 tt0 -70.35 -35.53 73.63 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 114.654 1.353 . . . . 3.05 114.654 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -63.0 -39.22 94.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 113.434 -3.307 . . . . 0.07 109.981 166.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.598 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 84.8 t80 -56.17 -30.41 62.19 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.25 1.574 . . . . 0.11 115.25 169.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -37.64 77.92 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 115.683 -2.407 . . . . 4.69 110.553 176.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.1 t -65.1 -34.55 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 116.624 -2.03 . . . . 0.11 113.238 173.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.598 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.1 m-30 -61.23 -48.54 80.98 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 112.103 -2.317 . . . . 0.21 111.228 -178.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -76.42 76.61 3.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 125.034 2.35 . . . . 1.46 111.368 166.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -60.05 -30.09 68.97 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 111.213 -2.721 . . . . 3.98 115.314 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -85.4 -26.21 26.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 112.393 -2.185 . . . . 3.1 112.418 175.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.76 27.08 73.69 Favored Glycine 0 C--N 1.344 1.001 0 CA-C-N 113.223 -1.808 . . . . 0.46 111.685 178.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -68.19 -16.79 64.13 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 125.307 1.24 . . . . 1.31 114.188 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.67 -14.7 64.46 Favored Glycine 0 C--N 1.343 0.962 0 O-C-N 125.422 1.701 . . . . 0.23 113.743 -175.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -114.38 146.76 40.15 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.295 -1.453 . . . . 20.0 109.651 -173.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.9 mm -113.27 135.0 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.768 0 CA-C-N 112.669 -2.06 . . . . 0.31 110.078 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.0 t -107.4 159.72 16.18 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 116.242 -2.183 . . . . 0.21 108.511 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -46.19 -43.45 15.24 Favored 'General case' 0 CA--C 1.548 0.883 1 CA-C-O 128.513 4.006 . . . . 0.11 113.226 177.681 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -54.62 -46.83 73.95 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 110.717 -2.947 . . . . 0.12 115.201 174.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -28.15 69.73 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 115.356 1.613 . . . . 0.81 115.356 172.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.564 ' HG ' ' HB3' ' A' ' 124' ' ' MET . 0.2 OUTLIER -54.64 -50.65 67.62 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 117.185 -1.806 . . . . 0.16 111.0 167.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -54.76 -28.52 49.21 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 117.358 -1.737 . . . . 3.52 115.256 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -62.86 -54.99 30.22 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 116.871 -1.932 . . . . 0.49 111.806 171.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.551 ' O ' HD23 ' A' ' 112' ' ' LEU . 2.7 m -57.68 -33.42 45.0 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 116.728 -1.989 . . . . 0.1 111.171 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.725 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 41.7 mmm -60.58 -44.52 96.11 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 123.292 1.52 . . . . 0.12 113.547 171.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.4 m -55.51 -45.18 77.14 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 113.62 -1.627 . . . . 0.18 112.384 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -59.24 -41.86 89.71 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 123.615 1.674 . . . . 1.12 112.826 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.551 HD23 ' O ' ' A' ' 108' ' ' VAL . 1.6 mm? -64.44 -7.5 10.15 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 112.688 -2.051 . . . . 0.45 112.363 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.8 -35.99 4.06 Favored Glycine 0 C--N 1.339 0.705 0 C-N-CA 117.835 -2.126 . . . . 0.41 110.796 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 109' ' ' MET . 33.2 mm-40 -108.5 111.07 22.75 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.574 -1.813 . . . . 2.29 110.645 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -93.32 130.12 39.18 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 113.932 -1.485 . . . . 1.51 111.056 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.478 HD23 ' HE2' ' A' ' 109' ' ' MET . 4.4 mm? -95.02 153.16 17.77 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 116.375 -2.13 . . . . 3.77 109.82 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.536 ' O ' HG23 ' A' ' 121' ' ' VAL . 44.6 p -76.21 169.57 17.96 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 113.725 -1.579 . . . . 0.3 112.333 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -52.48 -33.92 46.83 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.702 1.371 . . . . 1.6 114.702 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -52.31 65.99 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 126.751 3.167 . . . . 1.75 111.125 176.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 124' ' ' MET . 12.2 mm-40 -61.73 -35.71 78.86 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 109.286 -3.597 . . . . 0.68 112.526 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.623 HG12 ' HB1' ' A' ' 102' ' ' ALA . 88.3 t -55.12 -36.33 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 123.5 1.619 . . . . 0.44 114.15 176.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.08 -44.9 78.88 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 112.415 -2.175 . . . . 1.29 111.628 172.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -57.4 -28.74 63.5 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 118.146 -1.421 . . . . 3.19 114.281 168.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.564 ' HB3' ' HG ' ' A' ' 105' ' ' LEU . 25.9 mmt -65.96 -37.03 84.94 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 115.253 -0.885 . . . . 1.81 110.709 178.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 14.3 mt -56.82 -50.23 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 116.151 -2.22 . . . . 0.09 109.736 168.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -37.73 73.79 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 116.029 1.863 . . . . 4.42 116.029 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -78.72 -32.1 46.71 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-O 124.709 2.195 . . . . 1.95 112.226 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -89.08 -26.6 21.29 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 112.705 -2.043 . . . . 0.11 114.092 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -86.53 91.27 8.5 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 126.612 2.445 . . . . 1.93 111.45 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.0 mp -95.5 -32.94 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-N 114.019 -1.446 . . . . 0.45 112.791 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -67.83 -33.44 74.78 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 113.253 -1.794 . . . . 1.15 113.73 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.09 64.57 2.28 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 118.179 -1.962 . . . . 1.15 113.419 -176.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -119.48 -10.95 9.56 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 113.705 -1.248 . . . . 2.49 113.595 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.39 22.72 39.57 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 116.616 1.406 . . . . 0.31 116.616 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -156.3 164.87 37.8 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.084 1.354 . . . . 1.71 107.668 -174.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.473 HG13 ' HB1' ' A' ' 128' ' ' ALA . 94.3 t -115.54 119.54 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 115.84 -2.344 . . . . 0.35 107.133 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -104.78 175.14 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 116.001 -2.28 . . . . 2.45 114.969 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.68 -35.2 80.27 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 123.279 1.514 . . . . 20.0 113.899 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -62.94 -46.75 86.28 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 111.962 -2.381 . . . . 2.9 110.466 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 60.8 mt-10 -60.44 -31.07 70.07 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 110.394 -3.094 . . . . 2.77 114.854 171.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.96 -41.16 74.3 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 124.204 1.955 . . . . 0.38 112.195 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.7 t -69.13 -49.69 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 112.239 -2.255 . . . . 0.4 112.109 171.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.414 ' HB3' ' HA ' ' A' ' 140' ' ' GLU . 12.5 tp60 -56.06 -27.35 53.04 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 114.205 -1.362 . . . . 1.57 114.671 -178.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -53.3 8.66 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 124.155 1.931 . . . . 0.79 110.899 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 33.0 mtt -76.47 -54.29 6.93 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 114.614 -2.834 . . . . 0.36 114.731 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 23.3 m -57.08 -59.74 4.63 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.345 -1.752 . . . . 0.82 112.686 173.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 52.66 -159.09 0.13 Allowed 'General case' 0 C--N 1.345 0.376 0 O-C-N 124.884 1.365 . . . . 1.28 111.47 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt . . . . . 0 C--N 1.347 0.49 0 CA-C-O 118.462 -0.78 . . . . 20.0 111.052 175.074 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' HLT . . . . . 0.725 'BR ' ' SD ' ' A' ' 109' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 . . . . . 0 CA--C 1.502 -0.897 0 N-CA-C 106.95 -1.5 . . . . 1.97 106.95 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -37.13 47.88 Favored 'General case' 0 C--O 1.218 -0.571 0 O-C-N 125.895 1.997 . . . . 2.22 114.013 168.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -50.63 -59.74 3.75 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 123.943 1.83 . . . . 2.28 111.778 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 16.9 pt -73.02 -49.25 40.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 116.242 -2.183 . . . . 0.3 115.481 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.43 -55.05 7.66 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 113.269 -1.787 . . . . 2.72 113.948 -175.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -70.12 -35.27 73.99 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 117.9 -1.52 . . . . 3.05 113.807 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.69 92.9 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 113.974 -3.091 . . . . 0.07 109.305 170.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.55 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 76.4 t80 -56.45 -32.09 64.6 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 114.998 1.481 . . . . 0.11 114.998 168.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -65.96 -36.88 84.54 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 115.6 -2.44 . . . . 4.69 113.521 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.1 t -70.26 -28.41 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 117.809 -1.556 . . . . 0.11 113.058 171.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.55 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 18.8 m-30 -63.03 -49.98 72.5 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 113.067 -1.879 . . . . 0.21 111.571 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -76.5 79.32 3.2 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 126.959 2.662 . . . . 1.46 109.796 167.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -58.19 -30.46 66.47 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 111.435 -2.621 . . . . 3.98 113.879 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.418 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 21.3 p-10 -91.48 -17.39 25.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 113.525 -1.671 . . . . 3.1 113.756 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.66 20.47 79.63 Favored Glycine 0 C--N 1.343 0.931 0 C-N-CA 117.486 -2.292 . . . . 0.46 112.828 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.448 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -63.66 -9.22 12.78 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 116.321 1.971 . . . . 1.31 116.321 -178.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.448 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 91.18 -31.3 5.75 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 124.821 1.326 . . . . 0.23 115.056 -171.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -110.81 145.87 37.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 112.806 -1.697 . . . . 20.0 112.651 -172.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' A' ' 104' ' ' GLU . 13.6 mm -102.88 133.84 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-N 112.146 -2.297 . . . . 0.31 110.01 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.9 t -107.23 159.12 16.59 Favored 'General case' 0 CA--C 1.503 -0.832 0 C-N-CA 115.197 -2.601 . . . . 0.21 108.017 170.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.445 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -47.53 -42.47 23.39 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 127.927 3.727 . . . . 0.11 112.141 178.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.07 87.42 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-N 111.593 -2.549 . . . . 0.12 115.174 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.579 ' OE1' HD13 ' A' ' 100' ' ' ILE . 4.4 tt0 -66.26 -25.46 66.89 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 114.986 1.476 . . . . 0.81 114.986 171.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 1.055 HD11 'BR ' ' A' ' 150' ' ' HLT . 0.2 OUTLIER -56.33 -45.83 80.16 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 116.293 -2.163 . . . . 0.16 111.306 167.298 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 -55.8 -28.22 55.11 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.176 1.941 . . . . 3.52 115.327 171.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.401 ' O ' ' HB ' ' A' ' 110' ' ' THR . 55.7 t60 -65.1 -52.2 56.86 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 116.313 -2.155 . . . . 0.49 112.008 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.648 HG22 HD13 ' A' ' 105' ' ' LEU . 1.2 m -55.65 -36.68 43.38 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.834 0 C-N-CA 116.233 -2.187 . . . . 0.1 111.612 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.789 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 50.0 mmm -60.24 -44.54 95.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 125.211 2.434 . . . . 0.12 113.581 173.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 107' ' ' HIS . 80.8 m -51.1 -47.01 62.02 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 112.815 -1.993 . . . . 0.18 113.053 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.41 -39.24 90.05 Favored 'General case' 0 C--O 1.216 -0.661 0 O-C-N 125.837 1.96 . . . . 1.12 113.443 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.481 HD23 ' O ' ' A' ' 108' ' ' VAL . 2.6 mm? -67.08 -7.96 26.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 123.38 1.562 . . . . 0.45 112.274 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 97.78 -37.92 3.29 Favored Glycine 0 C--N 1.342 0.865 0 C-N-CA 118.514 -1.803 . . . . 0.41 110.8 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.51 ' O ' ' HB3' ' A' ' 109' ' ' MET . 74.4 mm-40 -105.79 116.12 31.4 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-N 112.196 -2.002 . . . . 2.29 109.363 -173.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -94.41 128.91 41.25 Favored 'General case' 0 CA--C 1.502 -0.89 0 C-N-CA 115.718 -2.393 . . . . 1.51 111.239 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' A' ' 124' ' ' MET . 39.3 mt -93.2 157.89 16.04 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 116.193 -2.203 . . . . 3.77 109.949 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.6 p -81.02 175.09 10.99 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 117.312 -1.755 . . . . 0.3 111.406 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -58.44 -29.97 66.55 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 114.725 1.38 . . . . 1.6 114.725 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.72 -50.98 71.73 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-O 124.991 2.329 . . . . 1.75 111.095 175.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.48 ' O ' ' SD ' ' A' ' 124' ' ' MET . 17.6 mm-40 -63.51 -43.23 97.82 Favored 'General case' 0 C--O 1.207 -1.174 0 CA-C-N 109.716 -3.402 . . . . 0.68 110.693 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.604 ' O ' ' HB2' ' A' ' 124' ' ' MET . 72.6 t -51.51 -34.7 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 124.468 2.08 . . . . 0.44 115.022 174.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -65.35 -45.6 83.54 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 116.402 -2.119 . . . . 1.29 112.021 170.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -56.06 -29.09 60.0 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.262 -1.375 . . . . 3.19 114.008 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.604 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -63.07 -39.35 94.45 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 112.06 0.393 . . . . 1.81 112.06 174.399 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 24.2 mt -53.91 -48.95 62.32 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.573 0 C-N-CA 115.6 -2.44 . . . . 0.09 109.636 169.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -57.23 13.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 117.949 2.574 . . . . 4.42 117.949 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.92 -29.15 70.07 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 122.97 1.366 . . . . 1.95 112.191 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.542 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -91.2 -23.86 20.09 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 113.411 -1.722 . . . . 0.11 115.176 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -90.58 92.5 8.88 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 126.092 2.12 . . . . 1.93 111.743 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.443 HG21 ' HG2' ' A' ' 143' ' ' GLN . 3.8 mp -94.08 -34.32 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 123.355 1.55 . . . . 0.45 113.441 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -67.6 -31.61 71.77 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 113.448 -1.705 . . . . 1.15 113.291 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.47 64.71 2.32 Favored Glycine 0 C--N 1.343 0.921 0 C-N-CA 117.583 -2.246 . . . . 1.15 114.101 -176.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -119.7 -10.39 9.58 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 125.259 1.211 . . . . 2.49 113.731 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 21.52 47.07 Favored Glycine 0 C--N 1.354 1.547 0 N-CA-C 116.962 1.545 . . . . 0.31 116.962 -174.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -155.22 164.25 39.07 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.04 1.736 . . . . 1.71 108.564 -175.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.542 HG13 ' HB1' ' A' ' 128' ' ' ALA . 97.4 t -115.31 121.68 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 C-N-CA 116.629 -2.029 . . . . 0.35 107.883 -178.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -109.26 173.88 6.12 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 115.26 -2.576 . . . . 2.45 114.477 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -64.63 -35.38 80.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 123.998 1.856 . . . . 20.0 114.441 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -62.78 -44.68 95.53 Favored 'General case' 0 CA--C 1.492 -1.273 0 CA-C-N 111.69 -2.504 . . . . 2.9 110.311 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.512 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 70.3 mt-10 -62.66 -30.65 71.54 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 110.971 -2.831 . . . . 2.77 114.023 172.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -58.02 -37.53 74.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 124.494 2.093 . . . . 0.38 112.749 171.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.99 -49.71 54.08 Favored 'Isoleucine or valine' 0 C--N 1.345 0.397 0 CA-C-N 112.277 -2.238 . . . . 0.4 112.363 169.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.443 ' HG2' HG21 ' A' ' 130' ' ' ILE . 0.4 OUTLIER -58.06 -26.71 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.616 1.339 . . . . 1.57 114.616 -177.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.682 ' SD ' 'CL ' ' A' ' 150' ' ' HLT . 6.0 ttp -77.11 -49.74 14.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 122.993 1.377 . . . . 0.79 111.657 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 mtt -77.22 -52.4 9.29 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 115.883 -2.327 . . . . 0.36 114.627 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.3 m -57.72 -53.38 58.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 113.117 -1.856 . . . . 0.82 112.736 174.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.62 -168.7 0.1 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 125.342 1.651 . . . . 1.28 111.911 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? . . . . . 0 C--N 1.348 0.519 0 CA-C-N 115.498 -0.774 . . . . 20.0 112.138 -177.517 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' HLT . . . . . 1.055 'BR ' HD11 ' A' ' 105' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 CA--C 1.48 -1.744 0 CA-C-O 119.614 -0.232 . . . . 1.97 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -65.22 -35.69 81.84 Favored 'General case' 0 C--O 1.217 -0.655 0 O-C-N 126.337 2.273 . . . . 2.22 112.268 171.417 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 5.8 mm-40 -53.83 -55.33 27.62 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-O 126.056 2.836 . . . . 2.28 112.295 -176.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.4 pt -72.21 -52.18 25.81 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 111.214 -2.721 . . . . 0.3 114.288 175.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -75.19 -54.99 6.18 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 117.301 -1.76 . . . . 2.72 114.206 -174.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 83' ' ' GLU . 21.1 tt0 -67.11 -34.69 78.14 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 117.962 -1.495 . . . . 3.05 114.882 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 84' ' ' GLU . . . -62.7 -40.83 98.35 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 112.781 -3.568 . . . . 0.07 109.918 168.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.622 ' HA ' ' CD2' ' A' ' 92' ' ' PHE . 83.2 t80 -53.95 -31.55 50.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.744 1.757 . . . . 0.11 115.744 168.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -67.75 -36.93 81.43 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 117.651 -1.62 . . . . 4.69 112.618 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.57 -33.21 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 118.004 -1.478 . . . . 0.11 112.618 170.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.622 ' CD2' ' HA ' ' A' ' 89' ' ' PHE . 19.3 m-30 -59.95 -49.92 75.78 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 112.731 -2.031 . . . . 0.21 110.99 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -78.27 78.17 4.75 Favored 'General case' 0 CA--C 1.509 -0.619 0 O-C-N 125.813 1.946 . . . . 1.46 110.203 170.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -57.76 -29.68 65.01 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 112.361 -2.2 . . . . 3.98 114.605 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.419 ' OD2' ' OD1' ' A' ' 97' ' ' ASN . 19.9 p30 -89.15 -18.06 27.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 112.646 -2.07 . . . . 3.1 114.229 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 71.68 17.43 76.59 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 117.575 -2.25 . . . . 0.46 112.849 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.47 HD22 ' N ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -65.28 -8.86 19.86 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 115.813 1.783 . . . . 1.31 115.813 -177.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.47 ' N ' HD22 ' A' ' 97' ' ' ASN . . . 88.74 -29.32 5.89 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 116.121 1.209 . . . . 0.23 116.121 -173.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.412 ' O ' ' ND2' ' A' ' 97' ' ' ASN . 42.8 m-85 -110.43 146.79 35.27 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 113.4 -1.4 . . . . 20.0 111.79 -175.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.403 ' O ' ' HB ' ' A' ' 136' ' ' VAL . 32.4 mm -114.95 132.18 64.95 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 CA-C-N 112.225 -2.261 . . . . 0.31 110.231 -177.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -103.78 167.99 9.43 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 113.856 -3.137 . . . . 0.21 110.907 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.751 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -48.63 -42.65 34.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 127.528 3.537 . . . . 0.11 113.225 175.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -51.84 -41.7 62.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.572 -2.558 . . . . 0.12 115.284 174.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.546 ' O ' HG13 ' A' ' 108' ' ' VAL . 2.5 mt-10 -76.8 -28.79 55.74 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 113.618 -1.628 . . . . 0.81 114.927 173.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.575 HD23 HG11 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -56.05 -29.03 59.87 Favored 'General case' 0 C--O 1.221 -0.419 0 O-C-N 124.91 1.381 . . . . 0.16 111.956 168.669 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.95 ' NH2' ' OD1' ' A' ' 118' ' ' ASP . 35.1 ttm-85 -74.25 -34.24 63.55 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 114.296 -1.32 . . . . 3.52 113.244 171.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.497 ' O ' ' HB ' ' A' ' 110' ' ' THR . 12.3 t-160 -61.37 -46.47 90.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 116.421 -2.112 . . . . 0.49 111.006 172.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 105' ' ' LEU . 1.1 m -59.19 -38.52 74.81 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 113.74 -1.573 . . . . 0.1 110.814 175.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.495 ' SD ' ' HG ' ' A' ' 116' ' ' LEU . 2.0 mmt -58.18 -40.5 81.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 124.616 2.151 . . . . 0.12 114.493 173.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.54 HG23 ' HE3' ' A' ' 115' ' ' LYS . 52.8 m -52.98 -47.44 68.2 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 113.056 -1.884 . . . . 0.18 112.733 171.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -62.08 -38.01 87.18 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 126.958 2.661 . . . . 1.12 114.028 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.73 -14.46 52.58 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 113.355 -1.748 . . . . 0.45 111.937 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.11 -36.95 3.91 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 118.176 -1.964 . . . . 0.41 110.825 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 109' ' ' MET . 1.4 mt-10 -106.65 110.12 22.22 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 112.717 -1.741 . . . . 2.29 109.377 -173.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.54 ' HE3' HG23 ' A' ' 110' ' ' THR . 33.8 mttp -94.44 119.95 33.93 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 116.153 -2.219 . . . . 1.51 110.036 177.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.495 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 14.0 mt -95.53 161.0 14.24 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 114.424 -2.91 . . . . 3.77 109.893 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 121' ' ' VAL . 69.5 p -76.39 176.98 7.7 Favored 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 117.378 -1.729 . . . . 0.3 111.751 -174.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.95 ' OD1' ' NH2' ' A' ' 106' ' ' ARG . 1.5 m-20 -50.8 -39.19 52.19 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 115.061 1.504 . . . . 1.6 115.061 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.76 -54.05 39.38 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-O 125.928 2.775 . . . . 1.75 110.493 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.68 -33.83 76.52 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 109.724 -3.398 . . . . 0.68 113.343 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.751 HG12 ' HB1' ' A' ' 102' ' ' ALA . 94.3 t -56.09 -35.67 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 123.517 1.627 . . . . 0.44 114.694 171.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -64.3 -44.22 92.31 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 112.306 -2.225 . . . . 1.29 111.804 170.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.68 -29.3 66.52 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 117.317 -1.753 . . . . 3.19 114.077 168.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.441 ' SD ' ' HA ' ' A' ' 121' ' ' VAL . 39.4 mtt -68.76 -32.27 71.9 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 117.857 -1.068 . . . . 1.81 112.176 176.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 102' ' ' ALA . 37.8 mt -55.99 -51.02 65.98 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 117.132 -1.827 . . . . 0.09 108.666 166.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.593 ' C ' HH11 ' A' ' 126' ' ' ARG . 0.0 OUTLIER -54.6 -60.78 2.88 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 116.653 -2.019 . . . . 4.42 113.825 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.42 ' HA ' ' NH1' ' A' ' 126' ' ' ARG . 6.7 tp10 -61.76 -25.71 67.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.482 2.087 . . . . 1.95 113.726 -174.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.535 ' HB1' HG13 ' A' ' 136' ' ' VAL . . . -91.54 -23.19 20.0 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 113.001 -1.909 . . . . 0.11 115.381 176.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -92.27 93.39 8.63 Favored 'General case' 0 CA--C 1.523 -0.09 0 O-C-N 126.12 2.138 . . . . 1.93 110.096 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.3 mp -95.66 -34.47 5.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 114.392 -1.276 . . . . 0.45 113.245 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -66.64 -31.15 71.66 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 113.185 -1.825 . . . . 1.15 113.3 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.45 64.75 2.41 Favored Glycine 0 C--N 1.344 0.982 0 C-N-CA 117.996 -2.049 . . . . 1.15 113.6 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 p-10 -118.44 -12.2 9.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.254 -0.973 . . . . 2.49 113.611 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.83 19.27 48.34 Favored Glycine 0 C--N 1.355 1.614 0 N-CA-C 117.018 1.567 . . . . 0.31 117.018 -174.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -152.7 165.09 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.864 1.666 . . . . 1.71 108.477 -175.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.575 HG11 HD23 ' A' ' 105' ' ' LEU . 84.4 t -114.43 122.0 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 O-C-N 126.181 2.176 . . . . 0.35 108.349 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -109.59 174.51 5.83 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 114.239 -2.985 . . . . 2.45 112.581 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.433 ' HD2' ' OE2' ' A' ' 139' ' ' GLU . 34.3 t80 -65.51 -36.9 85.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.425 1.583 . . . . 20.0 113.875 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.433 ' OE2' ' HD2' ' A' ' 138' ' ' TYR . 12.7 mm-40 -62.56 -46.07 90.03 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 111.83 -2.441 . . . . 2.9 109.94 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.534 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 71.3 mt-10 -63.21 -30.64 71.74 Favored 'General case' 0 CA--C 1.501 -0.921 0 CA-C-N 111.252 -2.704 . . . . 2.77 114.468 172.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.55 ' O ' ' HG3' ' A' ' 145' ' ' MET . 10.0 t80 -58.68 -38.07 77.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 124.195 1.95 . . . . 0.38 111.954 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 139' ' ' GLU . 86.8 t -69.32 -47.55 72.72 Favored 'Isoleucine or valine' 0 C--N 1.344 0.365 0 CA-C-N 112.928 -1.942 . . . . 0.4 111.182 171.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.21 -30.53 64.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.522 1.304 . . . . 1.57 114.522 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.85 ' SD ' 'BR ' ' A' ' 150' ' ' HLT . 15.1 ttp -77.78 -46.52 21.4 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 123.792 1.758 . . . . 0.79 111.379 -179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 141' ' ' PHE . 2.0 mtt -76.83 -52.34 9.68 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 115.833 -2.347 . . . . 0.36 113.467 -179.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.5 m -58.79 -52.04 67.43 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 112.274 -2.239 . . . . 0.82 112.834 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . 56.68 -162.41 0.18 Allowed 'General case' 0 C--O 1.233 0.223 0 O-C-N 125.064 1.477 . . . . 1.28 111.128 -178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 12.5 tptt . . . . . 0 C--N 1.344 0.345 0 CA-C-O 118.334 -0.841 . . . . 20.0 111.51 179.827 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 992' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 993' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' HLT . . . . . 0.85 'BR ' ' SD ' ' A' ' 144' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_