data_2byf_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 2byf _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 ' 6' ' ' SER . . . . . 0.49 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.794 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.545 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.534 ' HB3' HD12 ' A' ' 20' ' ' LEU . 45.8 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.791 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.63 ' HE2' ' HD3' ' A' ' 100' ' ' LYS . 78.2 m-70 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.534 HD12 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.486 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.545 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.858 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.794 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' A' ' 26' ' ' PRO . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.858 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.547 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.674 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.589 ' HA ' HD13 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.456 ' CG1' HG22 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.674 HG13 ' O ' ' A' ' 31' ' ' ALA . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.532 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.532 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 37.2 m-20 . . . . . 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.556 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.581 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 1.016 HD12 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.712 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.641 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.535 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.534 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.862 0.363 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.599 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.501 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.545 HG12 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.635 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.49 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.547 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.623 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.53 HG13 ' HZ ' ' A' ' 7' ' ' PHE . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.623 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 0.9 OUTLIER -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.515 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.439 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.481 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.641 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.63 ' HD3' ' HE2' ' A' ' 12' ' ' HIS . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 1.016 ' HB3' HD12 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.712 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.556 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.581 ' CA ' HG23 ' A' ' 58' ' ' VAL . 9.2 ptmm? . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 121.279 0.562 . . . . 0.0 109.76 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.759 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 12.5 p90 -113.8 154.77 26.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.061 -175.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -87.2 129.81 34.81 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 111.333 -176.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.5 t -115.73 127.82 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.348 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.549 ' HB3' HD12 ' A' ' 20' ' ' LEU . 34.6 mt-30 -102.05 107.09 18.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.774 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.6 OUTLIER -130.22 130.67 65.77 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.709 -174.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 . . . . . 0 C--N 1.316 -0.851 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.466 -175.969 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.549 HD12 ' HB3' ' A' ' 10' ' ' GLN . 56.4 tp . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.628 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 29.7 m -82.09 109.44 16.41 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.341 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.12 111.22 24.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.923 0.392 . . . . 0.0 109.979 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.551 HG13 ' HB ' ' A' ' 9' ' ' VAL . 17.7 pt -122.36 173.25 8.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.778 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -122.03 97.61 5.56 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.22 160.28 30.16 Favored Pre-proline 0 CA--C 1.504 -0.795 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.755 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.86 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.8 Cg_exo -66.01 141.83 65.81 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 121.848 1.699 . . . . 0.0 111.386 -177.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.759 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 38.0 mtp180 -63.69 -0.57 1.03 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.609 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.47 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.6 m -114.35 -9.96 12.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.642 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.86 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.6 p -53.86 133.45 42.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 110.935 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 21.4 p -96.81 -169.99 1.97 Allowed 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.485 ' HA ' HG11 ' A' ' 88' ' ' VAL . . . -59.03 -48.55 81.19 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.248 178.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.45 -32.59 67.09 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 123.15 0.281 . . . . 0.0 111.398 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -74.44 -53.74 8.96 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 122.245 1.022 . . . . 0.0 109.94 -176.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.668 HG12 HG12 ' A' ' 88' ' ' VAL . 5.1 p -65.95 -27.47 41.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.126 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.807 HD11 HD11 ' A' ' 103' ' ' LEU . 3.1 mm -56.07 -58.22 5.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.141 171.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 28.2 tt0 -72.45 -32.33 66.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.293 -175.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -59.47 -35.26 73.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 122.106 -0.371 . . . . 0.0 110.683 176.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.9 m -68.89 -41.09 78.75 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 9.7 mp -54.13 -40.88 67.8 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.653 172.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.8 t -67.81 -33.31 74.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.468 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -73.18 -32.73 65.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.397 0.618 . . . . 0.0 109.972 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.423 177.774 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 CA--C 1.516 -0.35 0 CA-C-O 120.985 0.421 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 29.9 m-85 -109.89 150.15 28.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.183 0.516 . . . . 0.0 111.098 -177.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.602 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -126.06 160.33 33.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.675 168.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 1.015 HD13 ' HB3' ' A' ' 101' ' ' PHE . 1.2 tm? -116.78 135.03 54.07 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.834 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.8 OUTLIER -98.41 130.71 45.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.09 -176.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.655 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.8 pt-20 -96.93 91.11 5.46 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.435 1.112 . . . . 0.0 108.52 169.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.649 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 3.3 tt0 -88.21 123.03 32.43 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 121.227 -0.921 . . . . 0.0 109.705 172.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.5 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -112.45 117.46 55.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.316 0.579 . . . . 0.0 109.564 169.836 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.651 HG22 ' HA3' ' A' ' 99' ' ' GLY . 51.8 t . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.21 -176.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.827 0.346 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.9 m -83.86 96.94 8.94 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 176.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.61 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.0 tt0 -97.79 131.7 44.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.879 -0.601 . . . . 0.0 109.993 -175.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.556 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 24.5 ttt180 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.754 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -110.35 140.55 28.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.482 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.5 mt -100.89 150.11 23.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.215 0.531 . . . . 0.0 111.653 -174.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.36 156.36 38.45 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 162.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.16 -32.99 38.37 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.811 0.338 . . . . 0.0 111.738 -175.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -110.38 19.64 18.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.8 -9.56 45.38 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.835 178.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 85.4 m 68.44 106.73 0.05 Allowed 'General case' 0 C--O 1.219 -0.537 0 O-C-N 123.931 0.769 . . . . 0.0 111.471 175.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.668 HG12 HG12 ' A' ' 34' ' ' VAL . 17.0 m -72.34 -32.08 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.159 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -73.47 -37.19 65.86 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 118.881 -1.128 . . . . 0.0 109.042 178.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.62 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 57.4 mt-30 -62.0 -45.74 92.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.84 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.8 -44.03 81.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.74 -37.58 76.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.049 -178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 65.1 p -76.28 -11.99 60.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.835 0.35 . . . . 0.0 111.318 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.62 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 86.5 mttt -82.91 -21.8 34.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.228 0.537 . . . . 0.0 109.705 177.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.437 ' CG ' ' HB ' ' A' ' 63' ' ' VAL . 43.4 m0 -64.34 157.77 25.33 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.719 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -137.7 19.23 2.87 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.174 175.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -160.6 165.61 35.11 Favored Glycine 0 N--CA 1.441 -0.978 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.415 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -86.76 104.76 16.45 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 117.99 0.895 . . . . 0.0 110.816 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.651 ' HA3' HG22 ' A' ' 64' ' ' VAL . . . -107.76 -147.61 13.47 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.147 -1.025 . . . . 0.0 112.147 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -150.43 153.93 36.81 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 176.136 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 1.015 ' HB3' HD13 ' A' ' 59' ' ' LEU . 96.8 m-85 -87.0 154.74 20.54 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 166.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.834 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 4.9 mp -135.18 127.18 47.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 121.66 -0.65 . . . . 0.0 110.951 -178.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.807 HD11 HD11 ' A' ' 35' ' ' ILE . 7.6 tp -83.14 127.53 33.68 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.48 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 5.6 tppt? -149.11 175.82 11.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.1 mp -98.17 144.17 27.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 0.0 110.491 172.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.602 ' CA ' HG23 ' A' ' 58' ' ' VAL . 9.2 ptmt . . . . . 0 C--N 1.316 -0.867 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.166 -176.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.401 ' OG ' ' HE2' ' A' ' 24' ' ' LYS . 57.1 p . . . . . 0 N--CA 1.445 -0.704 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.627 ' CD1' ' HA ' ' A' ' 27' ' ' ARG . 6.9 p90 -148.66 153.5 38.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -90.9 128.25 36.69 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.505 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.548 HG21 ' CE2' ' A' ' 7' ' ' PHE . 2.6 t -108.97 125.66 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.254 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.604 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 84.1 mt-30 -93.61 107.38 19.24 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.771 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -124.14 115.69 45.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.429 0.633 . . . . 0.0 110.576 -178.353 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.573 ' HB2' HG13 ' A' ' 102' ' ' ILE . 45.0 m-70 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.601 -175.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.549 HD11 ' CD2' ' A' ' 12' ' ' HIS . 52.7 tp . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 34.1 m -71.43 108.95 5.1 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.202 -176.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.4 t -96.14 111.06 25.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.4 pt -118.8 176.51 3.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.701 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.401 ' HE2' ' OG ' ' A' ' 6' ' ' SER . 51.4 tttt -124.9 97.75 5.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.44 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -98.86 170.98 6.22 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.138 -176.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.883 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.8 Cg_endo -75.64 140.8 24.14 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 C-N-CA 122.165 1.91 . . . . 0.0 110.14 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.627 ' HA ' ' CD1' ' A' ' 7' ' ' PHE . 90.7 mtt180 -54.24 -42.92 70.43 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 m -68.63 -10.37 13.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.951 178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.883 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 85.9 p -57.02 128.77 38.66 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.422 0.63 . . . . 0.0 110.783 177.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -102.3 179.19 4.38 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 171.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.773 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.42 -50.3 31.61 Favored 'General case' 0 C--O 1.213 -0.865 0 O-C-N 123.297 0.373 . . . . 0.0 111.013 -174.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.467 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -56.35 -35.45 67.65 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.96 -52.97 11.15 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.935 0.874 . . . . 0.0 110.021 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.797 HG12 HD23 ' A' ' 59' ' ' LEU . 5.3 p -63.13 -27.44 43.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.89 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.773 HG12 ' O ' ' A' ' 31' ' ' ALA . 3.5 mm -55.75 -58.26 5.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.128 173.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.482 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 6.3 tp-100 -69.39 -33.63 73.31 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.024 -177.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.44 HE22 ' HA ' ' A' ' 25' ' ' ALA . 17.6 tt0 -65.52 -36.67 84.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.48 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.2 m -70.52 -35.62 73.27 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.561 HD11 ' O ' ' A' ' 35' ' ' ILE . 6.9 mp -54.44 -46.21 73.22 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.443 171.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.06 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -79.95 -23.3 41.79 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.777 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.44 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -172.536 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 15.5 m-20 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 120.769 0.318 . . . . 0.0 111.446 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 50.0 m-85 -103.69 152.94 21.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.482 0.658 . . . . 0.0 111.425 -175.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.616 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -136.03 161.89 37.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 168.621 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.797 HD23 HG12 ' A' ' 34' ' ' VAL . 21.1 tp -115.29 148.39 39.26 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.484 -0.487 . . . . 0.0 109.98 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.689 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.3 mm? -106.44 134.56 49.39 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.797 ' HB3' HD22 ' A' ' 82' ' ' LEU . 12.6 pt-20 -98.87 87.34 3.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 122.378 1.085 . . . . 0.0 108.665 170.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.613 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 0.4 OUTLIER -87.07 124.47 33.26 Favored 'General case' 0 N--CA 1.414 -2.255 0 O-C-N 121.656 -0.652 . . . . 0.0 109.757 174.73 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.576 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.6 OUTLIER -113.86 111.25 35.21 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.422 174.054 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 92.5 t . . . . . 0 CA--C 1.512 -0.517 0 CA-C-O 121.389 0.614 . . . . 0.0 110.046 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.6 p . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 121.029 0.443 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.509 ' HB3' HG11 ' A' ' 63' ' ' VAL . 11.9 t -87.6 99.28 11.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 6.9 tt0 -94.93 131.69 40.58 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.273 -0.422 . . . . 0.0 109.927 -175.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.639 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 27.1 ttt180 -126.72 157.57 38.74 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.626 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -111.99 144.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 118.482 0.583 . . . . 0.0 110.104 177.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.934 HD23 ' HG2' ' A' ' 86' ' ' GLU . 16.5 mt -103.17 154.64 19.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.237 0.541 . . . . 0.0 111.575 -173.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.403 HD11 ' N ' ' A' ' 83' ' ' LEU . 6.7 mp -87.24 176.0 7.77 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.758 170.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -47.27 -51.31 19.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.463 0.477 . . . . 0.0 111.475 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -115.03 41.64 2.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.934 ' HG2' HD23 ' A' ' 82' ' ' LEU . 14.1 tp10 -62.34 -28.46 69.77 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.597 ' HB2' HE21 ' A' ' 90' ' ' GLN . 22.9 m 73.21 122.04 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.482 -175.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.463 ' H ' ' HA ' ' A' ' 30' ' ' THR . 94.0 t -74.68 -36.97 42.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.024 -173.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' A' ' 27' ' ' ARG . 86.7 t80 -73.39 -34.3 65.46 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.597 HE21 ' HB2' ' A' ' 87' ' ' CYS . 13.8 mt-30 -64.92 -44.73 88.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.87 175.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.912 ' HA ' ' HZ3' ' A' ' 94' ' ' LYS . . . -62.9 -46.69 86.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.039 0.447 . . . . 0.0 110.452 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -56.16 -38.8 71.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.372 -178.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.7 p -74.3 -5.01 39.64 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.912 ' HZ3' ' HA ' ' A' ' 91' ' ' ALA . 10.8 mttp -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.2 0.524 . . . . 0.0 110.643 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -64.41 155.36 32.77 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.871 -173.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.425 ' H ' HG23 ' A' ' 63' ' ' VAL . 98.8 mttt -130.8 18.34 5.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.13 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -163.7 166.79 37.53 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 109.278 -1.529 . . . . 0.0 109.278 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.31 93.27 8.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 118.018 0.909 . . . . 0.0 111.088 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.595 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -100.98 -150.23 23.97 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.206 -0.997 . . . . 0.0 112.024 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -151.89 155.56 38.35 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 175.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.771 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.5 m-85 -86.52 124.48 32.88 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.689 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -102.17 122.09 54.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.801 -0.562 . . . . 0.0 110.397 -174.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.9 tp -75.29 135.49 40.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.412 ' HE2' ' HB2' ' A' ' 104' ' ' LYS . 16.5 ttmm -156.86 176.6 12.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 6.6 mp -104.19 143.98 32.21 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.616 ' CA ' HG23 ' A' ' 58' ' ' VAL . 12.1 ptmm? . . . . . 0 C--N 1.309 -1.165 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.186 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.3 p . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 120.9 0.381 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.923 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.4 p90 -116.51 152.49 33.97 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.415 ' CE2' ' HD3' ' A' ' 24' ' ' LYS . 69.4 m-85 -89.42 131.8 35.3 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.445 -175.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.438 HG21 ' CE2' ' A' ' 7' ' ' PHE . 1.8 t -122.33 155.85 27.25 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 176.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.405 ' HB2' HD13 ' A' ' 20' ' ' LEU . 5.1 pm0 -129.46 107.3 9.38 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 163.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.631 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -115.04 140.07 38.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.477 -176.77 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 . . . . . 0 C--N 1.314 -0.975 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.863 -179.457 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.405 HD13 ' HB2' ' A' ' 10' ' ' GLN . 58.9 tp . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.362 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.461 HG23 HG21 ' A' ' 23' ' ' ILE . 20.7 m -112.1 107.94 17.05 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.506 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.3 t -86.43 111.06 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.462 HG23 ' HG3' ' A' ' 41' ' ' LYS . 9.9 pt -125.34 119.09 54.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.957 0.408 . . . . 0.0 111.779 -176.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HD3' ' CE2' ' A' ' 8' ' ' PHE . 21.3 ttpp -79.8 118.51 21.65 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.59 161.84 56.67 Favored Pre-proline 0 C--N 1.318 -0.801 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.669 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 7.5 Cg_exo -62.75 142.51 89.35 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 121.915 1.743 . . . . 0.0 111.907 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.923 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 46.4 mtp180 -63.51 -1.2 1.11 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.49 0.662 . . . . 0.0 110.015 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.485 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.4 m -107.9 -11.71 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.204 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.669 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 2.9 m -54.69 124.04 15.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.729 0.776 . . . . 0.0 112.826 176.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.636 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 1.8 t -98.33 177.47 5.36 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.545 171.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.529 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.35 -51.43 26.27 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.44 0.462 . . . . 0.0 111.362 -172.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.409 HE21 ' CA ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -64.82 -31.59 72.89 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.081 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -42.95 43.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 110.152 -176.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.515 ' CG1' HG23 ' A' ' 88' ' ' VAL . 1.3 p -72.5 -29.2 30.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.696 176.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 31' ' ' ALA . 5.9 mm -56.51 -57.33 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 171.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.473 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 26.7 tt0 -64.5 -31.43 72.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.934 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 34' ' ' VAL . 6.2 tp60 -63.44 -40.79 98.09 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.145 0.498 . . . . 0.0 109.765 175.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 m -67.92 -32.09 72.3 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.693 175.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.473 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.8 mp -61.61 -33.75 74.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.189 0.519 . . . . 0.0 110.727 173.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.6 m -68.9 -39.4 79.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.063 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.462 ' HG3' HG23 ' A' ' 23' ' ' ILE . 74.5 mmtt -78.74 -49.81 12.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.876 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.53 0 CA-C-O 121.716 0.769 . . . . 0.0 109.657 176.251 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.674 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.017 0.437 . . . . 0.0 111.085 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.557 ' CE1' HD23 ' A' ' 105' ' ' LEU . 15.9 m-85 -106.31 130.53 54.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.181 -175.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.599 HG21 ' O ' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -113.08 165.57 7.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 168.017 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.538 HD13 ' HB3' ' A' ' 101' ' ' PHE . 17.6 tp -118.56 138.38 52.59 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.586 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.4 mm? -98.72 126.55 44.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.792 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.676 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.6 pt-20 -88.81 84.35 6.67 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.609 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 12.7 tt0 -85.77 123.37 31.08 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 119.477 -0.889 . . . . 0.0 108.798 175.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.585 HG23 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.01 108.82 25.9 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.738 0.78 . . . . 0.0 110.327 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.558 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 78.9 t . . . . . 0 C--N 1.322 -0.594 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.558 -173.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.7 p . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -109.62 100.67 9.68 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.552 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.8 tt0 -95.05 131.27 41.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -134.35 129.89 36.13 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.541 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -85.86 136.47 22.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.269 -173.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 22.3 mt -93.63 151.8 19.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.501 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.452 ' HB2' ' HG2' ' A' ' 86' ' ' GLU . 7.1 mp -80.2 167.03 20.83 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 163.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -54.63 -31.86 57.99 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.636 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 2.3 pt20 -122.13 39.84 3.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 8.1 mm-40 -76.92 -7.51 55.69 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.262 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.665 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 12.7 t 70.21 130.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 0.0 111.333 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.569 ' H ' ' HA ' ' A' ' 30' ' ' THR . 93.8 t -78.58 -46.89 24.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 CA-C-O 121.344 0.592 . . . . 0.0 109.768 178.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -72.55 -41.37 65.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.557 -175.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.699 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 8.2 mm-40 -63.65 -43.61 96.25 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.345 175.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.88 -49.3 77.18 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.866 0.365 . . . . 0.0 110.436 175.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -57.64 -35.39 70.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.291 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -78.42 -5.96 53.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.012 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 73.1 mmtt -95.5 -12.64 25.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.227 0.536 . . . . 0.0 110.368 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.407 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 27.2 m0 -57.28 140.21 50.62 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -169.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.585 ' H ' HG23 ' A' ' 63' ' ' VAL . 3.7 mppt? -102.23 38.9 1.58 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.766 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 155.12 -175.5 33.09 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.93 -177.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.558 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.43 108.76 21.31 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.985 0.392 . . . . 0.0 110.168 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.609 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -113.46 -150.32 10.54 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.425 -177.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.467 ' HE2' ' HB2' ' A' ' 100' ' ' LYS . 27.8 mtmm -150.25 139.29 21.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.631 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 97.9 m-85 -83.23 146.49 28.55 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.753 -0.779 . . . . 0.0 108.971 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.586 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 80.1 mt -136.23 127.23 42.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 O-C-N 122.182 -0.324 . . . . 0.0 111.376 -172.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.501 ' HG ' HD12 ' A' ' 35' ' ' ILE . 4.7 mp -79.28 109.8 13.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.16 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.599 ' O ' HG21 ' A' ' 58' ' ' VAL . 33.6 ttpt -139.67 136.93 34.78 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 176.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.584 HD21 ' O ' ' A' ' 56' ' ' ASP . 18.5 mt -69.17 142.64 54.26 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.461 0.648 . . . . 0.0 112.507 -171.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.4 ptmm? . . . . . 0 C--N 1.314 -0.953 0 CA-C-N 114.427 -1.261 . . . . 0.0 110.084 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m . . . . . 0 N--CA 1.447 -0.612 0 CA-C-O 121.664 0.745 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.846 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 16.5 p90 -115.78 149.84 37.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.598 -1.183 . . . . 0.0 107.896 176.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -82.73 119.8 24.78 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.563 -173.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.579 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.7 t -108.72 130.98 60.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.652 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.433 ' HG2' HG23 ' A' ' 22' ' ' VAL . 45.9 mt-30 -104.15 109.01 20.65 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 164.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.627 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.5 p -129.23 121.65 54.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.066 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.607 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 91.1 m-70 . . . . . 0 C--N 1.318 -0.767 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.039 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 12' ' ' HIS . 64.6 tp . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 120.738 0.304 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.484 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.5 m -94.81 124.89 39.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.528 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.433 HG23 ' HG2' ' A' ' 10' ' ' GLN . 46.8 t -102.86 112.92 38.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 171.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.579 HG13 ' HB ' ' A' ' 9' ' ' VAL . 3.1 pt -128.3 168.25 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.132 0.492 . . . . 0.0 111.626 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -117.85 96.98 5.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.67 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -100.69 157.65 33.33 Favored Pre-proline 0 CA--C 1.499 -0.998 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.741 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.9 Cg_exo -63.7 140.48 74.67 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 121.587 1.525 . . . . 0.0 111.436 -174.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.846 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 59.4 mtp180 -62.88 -0.74 0.72 Allowed 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 121.296 0.569 . . . . 0.0 110.421 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.472 ' H ' ' C ' ' A' ' 26' ' ' PRO . 32.9 m -114.57 -7.16 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.763 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.741 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -59.48 135.07 57.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.124 0.487 . . . . 0.0 110.707 177.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.45 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 9.7 p -99.62 -168.29 1.58 Allowed 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.45 ' HA ' ' CG1' ' A' ' 88' ' ' VAL . . . -60.54 -50.28 74.19 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.922 -176.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.612 ' HG2' ' HB2' ' A' ' 84' ' ' ASP . 0.1 OUTLIER -59.03 -30.97 68.42 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.736 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -73.75 -52.89 11.68 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.931 0.872 . . . . 0.0 109.824 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.401 HG12 HG12 ' A' ' 88' ' ' VAL . 6.8 p -66.11 -28.14 42.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.679 -1.6 . . . . 0.0 110.3 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.49 HD11 ' HG ' ' A' ' 103' ' ' LEU . 2.3 mm -55.87 -56.21 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.389 171.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.519 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 40.9 mt-30 -64.33 -32.22 73.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.183 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.67 HE22 ' HA ' ' A' ' 25' ' ' ALA . 7.6 tt0 -61.27 -39.02 88.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.049 179.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.3 m -67.88 -38.81 83.49 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.977 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -55.56 -38.6 69.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.639 174.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.64 -45.62 89.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.133 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -70.8 -35.65 72.63 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.787 0.327 . . . . 0.0 110.942 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.683 -178.304 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.282 0.563 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 42.1 m-85 -118.02 139.01 51.81 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.168 -174.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.57 HG11 ' HE2' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -104.99 178.9 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 162.062 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.561 ' HB3' HD13 ' A' ' 82' ' ' LEU . 21.0 tp -134.83 145.71 48.58 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.656 ' O ' ' HA ' ' A' ' 101' ' ' PHE . 2.6 mm? -102.05 126.92 49.11 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.618 ' HG2' ' HB3' ' A' ' 80' ' ' ARG . 11.2 pt-20 -92.32 83.75 5.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.491 1.139 . . . . 0.0 108.202 169.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.617 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -86.7 125.42 33.87 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.501 -0.75 . . . . 0.0 110.082 176.478 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.577 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.9 OUTLIER -117.54 111.33 34.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.28 0.562 . . . . 0.0 110.364 175.176 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.551 HG21 ' OE2' ' A' ' 62' ' ' GLU . 88.9 t . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.577 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 15.0 m . . . . . 0 C--O 1.235 0.331 0 CA-C-O 121.455 0.645 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -89.85 99.87 12.8 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.483 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.587 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 7.0 tt0 -94.36 131.57 39.87 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.618 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 50.2 ttt180 -127.44 149.73 49.96 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.598 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -111.86 135.07 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 118.959 0.799 . . . . 0.0 111.498 -175.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' A' ' 59' ' ' LEU . 35.2 mt -89.99 -161.58 0.8 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.802 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.448 ' HB3' ' OE2' ' A' ' 86' ' ' GLU . 37.0 tp -131.93 -51.68 0.97 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.839 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.612 ' HB2' ' HG2' ' A' ' 32' ' ' GLN . 17.7 p-10 177.34 -38.36 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.41 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.424 ' HG3' ' CG ' ' A' ' 84' ' ' ASP . 40.9 mt-30 -118.3 19.22 13.52 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -174.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.0 mp0 -62.69 -6.63 3.76 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -177.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 90.4 m 67.84 96.26 0.06 Allowed 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.531 0.52 . . . . 0.0 110.018 -176.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 31' ' ' ALA . 17.9 m -68.92 -27.21 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.282 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -71.42 -39.25 71.19 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.137 -1.025 . . . . 0.0 108.991 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.646 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 39.2 mm-40 -68.05 -43.33 78.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.576 176.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.7 79.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.455 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.9 -30.89 69.33 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.089 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.3 t -77.67 -19.67 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.514 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.646 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 31.5 mmtp -75.23 -23.86 57.61 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.956 0.407 . . . . 0.0 110.367 177.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.3 m0 -58.92 158.34 8.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -171.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -131.03 23.13 4.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 113.815 -1.539 . . . . 0.0 109.376 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -169.04 174.29 43.54 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -93.77 98.33 11.02 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 117.458 0.629 . . . . 0.0 110.99 -177.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.64 ' O ' ' HG3' ' A' ' 100' ' ' LYS . . . -106.53 -152.54 19.46 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.784 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.64 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 10.1 mtmm -156.39 149.63 24.35 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.656 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 94.4 m-85 -82.9 151.02 26.14 Favored 'General case' 0 C--N 1.312 -1.03 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.163 169.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.514 HG13 ' HB2' ' A' ' 12' ' ' HIS . 4.4 mp -130.58 125.56 59.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 121.959 -0.463 . . . . 0.0 110.62 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.49 ' HG ' HD11 ' A' ' 35' ' ' ILE . 1.9 mp -71.05 131.2 43.28 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -154.99 170.15 22.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.3 mp -96.15 145.18 25.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.493 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.57 ' HE2' HG11 ' A' ' 58' ' ' VAL . 15.7 ptpt . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.935 0.874 . . . . 0.0 110.043 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.446 -0.626 0 CA-C-O 121.322 0.582 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.836 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.0 p90 -105.91 154.73 20.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -84.9 128.67 34.72 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.162 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.427 ' CG1' HG23 ' A' ' 11' ' ' VAL . 0.8 OUTLIER -122.17 128.89 75.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.072 175.005 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' A' ' 20' ' ' LEU . 47.1 mt-30 -100.65 106.01 17.43 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 165.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.649 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -115.69 112.49 39.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.301 -169.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 21.5 m-70 . . . . . 0 C--N 1.32 -0.71 0 CA-C-O 121.156 0.503 . . . . 0.0 112.169 -173.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.537 HD12 ' HD3' ' A' ' 100' ' ' LYS . 5.7 mt . . . . . 0 CA--C 1.512 -0.519 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 18.8 m -93.52 108.56 20.24 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.424 175.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.5 p -92.51 119.61 40.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.438 0.637 . . . . 0.0 110.569 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 24.5 pt -128.78 144.13 39.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.345 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -98.32 95.39 7.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 170.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.63 165.17 14.21 Favored Pre-proline 0 CA--C 1.506 -0.744 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.701 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.65 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 6.1 Cg_exo -68.65 139.89 45.57 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 122.015 1.81 . . . . 0.0 112.129 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.836 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.8 mtp180 -61.76 -8.66 5.03 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.1 m -99.09 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.604 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.65 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 15.9 m -60.87 120.43 10.15 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.433 0.635 . . . . 0.0 111.5 174.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.511 ' CB ' ' HA ' ' A' ' 87' ' ' CYS . 1.8 t -100.0 179.07 4.61 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.35 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.602 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.2 -52.44 20.88 Favored 'General case' 0 C--O 1.216 -0.684 0 O-C-N 123.592 0.557 . . . . 0.0 111.697 -170.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.482 HE21 ' CA ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -63.86 -31.88 73.21 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -177.323 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.78 -50.34 21.05 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.8 0.81 . . . . 0.0 109.678 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.619 HG12 HD23 ' A' ' 59' ' ' LEU . 1.4 p -66.6 -27.9 41.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.442 179.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 31' ' ' ALA . 5.6 mm -56.23 -57.55 8.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.078 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.534 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 41.8 tt0 -67.26 -35.1 78.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -178.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -59.47 -43.6 93.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 120.892 0.377 . . . . 0.0 110.657 175.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.3 m -71.16 -31.63 67.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.046 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.534 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 4.8 mp -55.91 -39.61 71.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.198 0.523 . . . . 0.0 110.384 171.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.3 m -72.61 -29.7 63.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.012 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -75.08 -41.1 59.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.401 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.375 0.607 . . . . 0.0 110.509 176.507 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 79.1 m-20 . . . . . 0 CA--C 1.517 -0.299 0 CA-C-O 121.305 0.574 . . . . 0.0 109.701 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 33.4 m-85 -108.26 154.97 21.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.753 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.621 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.25 155.6 37.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 169.439 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.621 HD22 ' HB3' ' A' ' 101' ' ' PHE . 22.8 tp -103.1 146.75 27.91 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.991 0.425 . . . . 0.0 110.009 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.645 HD12 HG12 ' A' ' 81' ' ' VAL . 2.1 mm? -106.81 125.45 51.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.881 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.643 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.6 pt-20 -87.76 82.67 7.29 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.3 1.048 . . . . 0.0 108.271 170.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.539 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -87.4 123.55 32.47 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 121.555 -0.716 . . . . 0.0 109.7 176.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.691 HG23 ' H ' ' A' ' 96' ' ' LYS . 0.3 OUTLIER -119.39 118.11 56.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.107 178.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.553 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 63.3 t . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.396 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 13.4 p . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 120.912 0.387 . . . . 0.0 110.75 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.8 m -111.21 107.25 16.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.499 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 7.0 tt0 -93.8 131.03 39.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.88 0.371 . . . . 0.0 110.18 -172.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.47 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 55.2 ttt180 -128.01 151.62 48.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.645 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -106.18 144.28 15.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.99 -178.584 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.615 HD23 ' HB3' ' A' ' 61' ' ' GLU . 22.4 mt -101.71 150.88 22.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.566 -175.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -88.72 -173.49 4.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.151 170.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.23 -50.69 70.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 111.238 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -116.14 40.12 2.92 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.645 -177.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.426 ' HG3' ' NZ ' ' A' ' 94' ' ' LYS . 30.2 tp10 -76.1 -11.37 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 175.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.511 ' HA ' ' CB ' ' A' ' 30' ' ' THR . 67.1 m 65.0 126.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 114.6 -1.182 . . . . 0.0 112.623 172.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.476 HG23 HG12 ' A' ' 34' ' ' VAL . 64.6 t -76.03 -42.26 38.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.559 -174.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -72.26 -38.61 68.8 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.62 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -62.06 -42.1 98.84 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.87 174.822 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.523 ' HA ' ' CE ' ' A' ' 94' ' ' LYS . . . -60.5 -43.95 96.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.638 176.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -61.17 -31.75 71.49 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.546 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.1 t -77.12 -13.84 59.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.111 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.62 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 64.4 mttt -85.1 -18.27 34.78 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.493 0.663 . . . . 0.0 110.285 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.454 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.9 m0 -62.32 145.79 52.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.355 -170.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.691 ' H ' HG23 ' A' ' 63' ' ' VAL . 20.5 mttp -115.41 23.8 12.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.754 -1.566 . . . . 0.0 108.169 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 175.89 -171.44 44.49 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-N 114.072 -1.422 . . . . 0.0 110.227 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.11 108.56 20.01 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 117.304 0.552 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.551 ' HA2' ' HA ' ' A' ' 63' ' ' VAL . . . -114.85 -151.02 10.05 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.829 -177.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.537 ' HD3' HD12 ' A' ' 20' ' ' LEU . 1.1 mtmp? -150.46 149.56 30.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.649 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -91.2 124.08 35.14 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.874 168.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.0 mp -111.5 129.44 66.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.304 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 35' ' ' ILE . 3.8 mp -77.98 131.08 37.24 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.892 175.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.59 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.0 ttmm -145.87 -177.1 5.41 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.59 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 4.7 mp -106.57 135.71 47.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.92 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.621 ' CA ' HG23 ' A' ' 58' ' ' VAL . 16.5 ptmt . . . . . 0 C--N 1.312 -1.037 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.344 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.607 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 7.9 p . . . . . 0 N--CA 1.444 -0.736 0 CA-C-O 121.088 0.471 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.751 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 18.0 p90 -107.26 148.3 29.13 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -79.59 131.7 36.08 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.758 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.421 ' CG1' HG13 ' A' ' 11' ' ' VAL . 1.9 t -122.81 142.64 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.571 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -111.56 107.07 16.11 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 167.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -122.63 139.65 48.86 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -175.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.674 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 92.5 m-70 . . . . . 0 C--N 1.314 -0.971 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.951 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.8 tp . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.26 108.76 7.24 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.489 -179.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.25 123.07 47.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 121.981 -0.449 . . . . 0.0 109.925 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.3 pt -130.36 175.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.147 0.499 . . . . 0.0 110.776 -178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.607 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 44.0 tttp -132.06 96.98 4.03 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 171.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.91 158.21 32.23 Favored Pre-proline 0 CA--C 1.5 -0.948 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.527 -176.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.724 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 8.1 Cg_exo -61.59 141.76 92.4 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.93 1.753 . . . . 0.0 111.625 -174.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.751 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.6 mtp-105 -61.79 -2.36 0.82 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.872 0.844 . . . . 0.0 110.235 -179.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.527 ' H ' ' C ' ' A' ' 26' ' ' PRO . 3.4 p -107.67 -21.95 5.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.413 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.724 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 98.8 p -56.18 127.76 32.28 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 120.93 0.395 . . . . 0.0 110.353 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.494 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 7.7 p -95.27 -166.51 1.47 Allowed 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.441 ' HA ' HG11 ' A' ' 88' ' ' VAL . . . -59.26 -50.05 75.5 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.042 -177.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.42 ' HB2' ' O ' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -60.72 -31.83 71.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 -178.067 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -73.29 -53.16 11.52 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 122.128 0.966 . . . . 0.0 109.797 -176.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.506 HG12 HG12 ' A' ' 88' ' ' VAL . 5.4 p -65.96 -27.96 42.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 113.771 -1.558 . . . . 0.0 110.29 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.516 HD11 ' HB3' ' A' ' 57' ' ' TYR . 4.3 mm -56.42 -56.52 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.134 170.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.457 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 34.6 tt0 -69.63 -33.4 72.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.384 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -62.03 -36.11 80.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.012 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.2 m -69.33 -37.3 77.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.899 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 7.4 mp -53.65 -44.21 69.41 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.157 0.503 . . . . 0.0 110.101 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.39 -36.19 82.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.08 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.34 -12.01 58.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.755 0.312 . . . . 0.0 111.56 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.547 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.596 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 m-20 . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.601 0.239 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.516 ' HB3' HD11 ' A' ' 35' ' ' ILE . 35.4 m-85 -103.56 145.82 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.829 -171.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.556 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -135.33 151.98 31.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.608 165.166 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.815 HD22 ' HB3' ' A' ' 101' ' ' PHE . 32.5 tp -104.51 147.17 27.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.041 0.448 . . . . 0.0 111.274 -174.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.546 HD12 HG12 ' A' ' 81' ' ' VAL . 1.7 mm? -102.84 124.9 49.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.732 176.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.658 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.5 pt-20 -88.82 87.31 7.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.232 1.015 . . . . 0.0 108.569 170.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.651 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 1.3 tt0 -85.86 124.47 32.37 Favored 'General case' 0 N--CA 1.426 -1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 109.685 175.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.553 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -118.18 113.8 43.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-O 121.188 0.518 . . . . 0.0 110.159 175.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.552 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.593 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.2 p . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.7 m -86.51 101.0 12.78 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.525 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.588 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 33.2 tt0 -93.91 129.86 40.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.86 -175.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.467 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 38.5 ttt-85 -125.84 147.38 49.46 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.546 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -101.65 143.24 14.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.362 178.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.539 HD11 ' HB3' ' A' ' 59' ' ' LEU . 45.3 mt -98.57 162.96 12.86 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.609 -176.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.541 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 58.6 mt -84.65 174.68 9.76 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 166.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 11.3 m-20 -55.05 -44.24 74.55 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.911 0.386 . . . . 0.0 110.546 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -121.35 53.36 1.17 Allowed 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.629 0.252 . . . . 0.0 111.374 176.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.541 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.2 OUTLIER -75.04 -4.29 37.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.559 174.283 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.494 ' HA ' ' HB ' ' A' ' 30' ' ' THR . 47.1 m 64.39 105.72 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.179 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.541 HG12 HD21 ' A' ' 59' ' ' LEU . 17.9 m -74.39 -27.37 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 O-C-N 122.311 -0.243 . . . . 0.0 111.585 -178.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -70.82 -38.58 73.27 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.435 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -63.65 -48.28 77.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.074 175.604 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.52 -50.51 67.69 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.401 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.502 ' OE1' ' HE2' ' A' ' 7' ' ' PHE . 20.8 tt0 -63.63 -37.18 86.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.707 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.4 p -75.4 -10.36 59.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.532 0.682 . . . . 0.0 110.263 176.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -101.94 -0.43 33.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.646 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.442 ' C ' ' HD3' ' A' ' 96' ' ' LYS . 40.3 m0 -75.62 158.42 32.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 122.131 0.967 . . . . 0.0 112.78 175.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.486 ' H ' HG22 ' A' ' 63' ' ' VAL . 3.8 mppt? -126.94 29.87 5.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 113.466 -1.697 . . . . 0.0 109.228 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -175.36 -153.01 9.81 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.887 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -121.22 104.39 9.7 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.825 0.345 . . . . 0.0 110.248 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.651 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -114.56 -154.46 10.9 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.075 -1.059 . . . . 0.0 113.112 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.864 ' HZ1' ' HB2' ' A' ' 100' ' ' LYS . 4.8 mtmp? -151.77 137.3 17.75 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.352 0.661 . . . . 0.0 109.76 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.815 ' HB3' HD22 ' A' ' 59' ' ' LEU . 92.3 m-85 -81.21 119.56 23.77 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.878 174.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 58.2 mt -110.26 120.16 60.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 O-C-N 121.993 -0.442 . . . . 0.0 111.122 -172.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.646 HD13 HD11 ' A' ' 59' ' ' LEU . 1.6 mp -71.08 128.55 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.394 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 18.3 ttmm -144.71 -177.76 5.67 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 175.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.497 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 38.7 mt -110.05 149.61 29.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.641 0.734 . . . . 0.0 111.852 -179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 19.0 ptmt . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.136 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.556 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 9.8 p . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 121.073 0.463 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.886 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.6 p90 -104.75 154.03 20.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -83.95 137.95 33.38 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.65 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.524 HG21 ' CE2' ' A' ' 7' ' ' PHE . 2.1 t -128.23 139.52 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.828 0.347 . . . . 0.0 110.265 176.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -107.58 106.29 16.57 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 165.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.692 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -116.45 134.38 60.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 . . . . . 0 C--N 1.312 -1.057 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.96 -178.048 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -92.14 109.94 21.31 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.336 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.9 p -91.82 112.74 26.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.782 0.801 . . . . 0.0 110.553 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.8 pt -121.17 171.19 10.2 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.741 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.556 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 41.5 tttp -129.25 96.12 4.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 172.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.22 161.57 22.5 Favored Pre-proline 0 CA--C 1.507 -0.706 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.324 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.961 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.9 Cg_exo -64.91 143.35 79.15 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 121.779 1.653 . . . . 0.0 111.817 -172.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.886 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 58.5 mtp85 -63.23 -1.68 1.13 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.317 0.579 . . . . 0.0 110.48 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.473 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.6 m -118.69 -0.88 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.524 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.961 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 84.4 p -59.89 139.09 57.61 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.132 0.491 . . . . 0.0 110.846 175.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.651 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 1.8 t -107.35 179.22 4.31 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.498 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.99 -48.97 61.22 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 123.206 0.316 . . . . 0.0 111.495 -175.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.418 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -59.65 -32.54 70.55 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.539 0.209 . . . . 0.0 110.911 -179.177 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.66 -54.18 9.75 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.059 0.933 . . . . 0.0 109.973 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.555 ' CG1' HD21 ' A' ' 59' ' ' LEU . 9.8 p -64.57 -27.34 42.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.748 -1.569 . . . . 0.0 109.849 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.669 HD12 HD13 ' A' ' 103' ' ' LEU . 6.1 mm -56.97 -56.15 16.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.066 167.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.9 tm0? -67.2 -34.64 77.93 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.791 -175.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -65.53 -48.95 70.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.477 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.421 ' HB ' HD11 ' A' ' 103' ' ' LEU . 20.6 m -63.68 -39.25 93.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.331 0.586 . . . . 0.0 110.14 178.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.45 -43.81 93.1 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.716 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.9 t -62.39 -33.98 75.82 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.734 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -75.33 -43.45 50.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.815 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.444 -177.678 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.572 ' C ' ' HG2' ' A' ' 106' ' ' LYS . 4.1 m-20 . . . . . 0 N--CA 1.448 -0.533 0 CA-C-O 121.324 0.583 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.666 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 31.7 m-85 -115.17 166.0 12.31 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.96 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.59 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -142.85 171.41 9.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.578 171.432 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.76 HD23 ' HB3' ' A' ' 101' ' ' PHE . 9.7 tp -124.0 145.48 49.17 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.789 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.7 mm? -98.78 130.34 45.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.631 179.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.593 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.7 pt-20 -95.55 84.92 4.05 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.404 1.097 . . . . 0.0 108.613 170.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.653 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 15.2 tt0 -85.62 124.23 31.93 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 121.465 -0.772 . . . . 0.0 108.961 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.512 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -114.46 110.09 30.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.515 HG22 ' HA3' ' A' ' 99' ' ' GLY . 61.3 t . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.721 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.6 m . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 m -82.23 99.53 9.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.549 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 25.8 tt0 -95.44 131.98 41.01 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 -174.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.465 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 21.7 tpp85 -129.1 159.98 34.28 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.664 HG12 HD12 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -118.21 145.77 23.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 118.442 0.565 . . . . 0.0 111.149 -175.669 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.438 HD13 ' HB3' ' A' ' 59' ' ' LEU . 42.4 mt -101.62 177.22 4.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.918 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' ASP . 30.4 tp -113.98 -49.39 2.86 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.929 0.492 . . . . 0.0 110.408 -175.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LEU . 3.5 p-10 178.46 -45.79 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.664 172.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.651 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 3.0 pt20 -117.35 34.65 5.02 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.0 mp0 -65.73 -14.78 61.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.863 -0.153 . . . . 0.0 111.213 173.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 68.2 m 66.88 104.87 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.558 0 O-C-N 123.795 0.684 . . . . 0.0 110.131 -174.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.529 ' H ' ' HA ' ' A' ' 30' ' ' THR . 15.2 m -74.79 -30.76 24.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -173.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -72.63 -37.86 67.91 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.554 -0.858 . . . . 0.0 108.804 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.671 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 9.0 mm100 -65.02 -43.54 92.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.913 173.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.48 88.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 0.0 110.223 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -57.94 -42.29 84.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.57 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.5 p -72.84 -12.53 61.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.679 -177.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.671 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 70.0 mmtt -87.25 -16.32 35.56 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.196 0.522 . . . . 0.0 110.823 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.4 m0 -60.73 157.9 13.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.438 -176.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.415 ' H ' HG22 ' A' ' 63' ' ' VAL . 25.0 mtmm -129.85 28.3 5.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.725 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.47 ' O ' HG21 ' A' ' 63' ' ' VAL . . . -178.22 159.02 24.23 Favored Glycine 0 N--CA 1.442 -0.941 0 CA-C-N 113.802 -1.544 . . . . 0.0 109.644 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.482 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -81.62 106.8 13.86 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 117.504 0.652 . . . . 0.0 110.684 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.653 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -110.47 -151.96 13.05 Favored Glycine 0 N--CA 1.434 -1.471 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.033 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.448 ' HG3' ' C ' ' A' ' 99' ' ' GLY . 8.2 mtmt -149.79 144.2 25.86 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.76 ' HB3' HD23 ' A' ' 59' ' ' LEU . 86.2 m-85 -82.11 152.55 26.5 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.315 169.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.789 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 76.2 mt -138.67 126.4 27.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.176 -0.327 . . . . 0.0 111.072 -174.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.669 HD13 HD12 ' A' ' 35' ' ' ILE . 4.7 tp -75.57 134.63 40.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.6 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 8.4 tppt? -150.52 176.32 11.07 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.666 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.3 tp -103.69 139.19 39.29 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.59 ' CA ' HG23 ' A' ' 58' ' ' VAL . 17.5 ptmt . . . . . 0 C--N 1.322 -0.616 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.009 -174.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.45 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 49.8 p . . . . . 0 N--CA 1.445 -0.677 0 CA-C-O 121.117 0.484 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.767 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.8 p90 -135.15 147.02 49.33 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -85.68 137.06 33.09 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.113 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.447 HG21 ' CE2' ' A' ' 7' ' ' PHE . 1.2 t -123.43 142.65 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.078 0.466 . . . . 0.0 110.477 176.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.455 ' HB3' HD13 ' A' ' 20' ' ' LEU . 38.9 mt-30 -110.62 107.38 16.95 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 166.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -123.18 139.11 50.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -177.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.467 ' HB2' HG12 ' A' ' 102' ' ' ILE . 10.5 m-70 . . . . . 0 C--N 1.315 -0.934 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.736 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.455 HD13 ' HB3' ' A' ' 10' ' ' GLN . 65.4 tp . . . . . 0 N--CA 1.446 -0.661 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.423 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 8.3 m -70.33 109.2 4.58 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.666 -177.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.0 121.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 pt -129.71 164.3 32.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.745 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.45 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 28.7 tttp -118.14 105.27 11.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.03 169.24 6.55 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.22 -174.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.732 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.3 Cg_endo -75.43 141.02 24.97 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 122.147 1.898 . . . . 0.0 111.993 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.767 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.7 mtp-105 -61.8 -6.17 2.5 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 122.147 0.975 . . . . 0.0 110.166 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.479 ' H ' ' C ' ' A' ' 26' ' ' PRO . 3.0 p -103.97 -20.52 5.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.194 -178.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.732 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 95.1 p -58.04 126.59 28.13 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 120.851 0.357 . . . . 0.0 110.08 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.441 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 28.4 p -94.78 -164.78 1.21 Allowed 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.459 ' HB2' HD12 ' A' ' 82' ' ' LEU . . . -61.94 -50.18 73.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.83 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -59.59 -33.95 72.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.102 0.477 . . . . 0.0 110.48 -179.196 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -69.26 -53.26 20.75 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 122.163 0.982 . . . . 0.0 109.599 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.448 ' CG1' HD21 ' A' ' 59' ' ' LEU . 5.6 p -68.84 -28.24 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 CA-C-N 113.352 -1.749 . . . . 0.0 110.357 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.684 HD12 ' HG ' ' A' ' 103' ' ' LEU . 3.8 mm -57.16 -57.77 8.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.366 171.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.548 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 33.2 tt0 -68.06 -33.61 74.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.003 -175.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -59.29 -42.64 91.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.2 m -70.14 -37.04 75.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.917 176.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 3.5 mp -52.59 -47.45 66.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.327 0.584 . . . . 0.0 110.59 172.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 16.1 t -69.97 -29.28 66.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.212 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -81.88 -30.19 32.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.808 -176.489 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.606 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 11.7 m-20 . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 120.972 0.415 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.523 ' HB3' HD11 ' A' ' 35' ' ' ILE . 50.6 m-85 -101.54 145.1 29.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.653 -174.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.568 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -131.63 144.16 38.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.888 165.649 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.787 HD23 ' HB3' ' A' ' 101' ' ' PHE . 18.4 tp -97.03 142.56 28.82 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.407 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 HG11 ' A' ' 81' ' ' VAL . 1.4 mm? -98.44 129.62 45.06 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 176.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.65 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 12.4 pt-20 -93.25 87.76 5.78 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 170.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.617 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 3.5 tt0 -85.61 125.04 32.82 Favored 'General case' 0 N--CA 1.425 -1.694 0 O-C-N 121.045 -1.034 . . . . 0.0 109.783 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.613 HG23 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.82 112.65 39.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.322 0.582 . . . . 0.0 110.468 175.893 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.482 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.7 t . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.437 176.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.482 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 54.4 p . . . . . 0 N--CA 1.45 -0.465 0 CA-C-O 120.917 0.389 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.7 m -94.04 101.76 13.81 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.27 131.47 39.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.72 -175.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.498 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 33.8 ttt180 -124.63 153.85 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.518 HG11 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -109.26 130.17 62.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.552 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.526 HD11 ' HB3' ' A' ' 59' ' ' LEU . 21.2 mt -85.83 165.65 16.67 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.515 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 75.0 mt -84.39 178.93 7.56 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 166.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 33.5 m-20 -55.22 -48.33 74.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.191 0.519 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -121.69 50.78 1.38 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.121 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.463 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -71.82 -3.96 25.19 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 174.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 32.6 m 66.11 104.69 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.188 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.441 ' H ' ' HA ' ' A' ' 30' ' ' THR . 23.6 m -74.45 -26.25 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.508 0 O-C-N 122.228 -0.295 . . . . 0.0 111.641 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -71.97 -35.18 69.44 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.479 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -66.32 -48.15 71.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.199 175.123 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.409 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -54.4 -48.83 71.14 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.969 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -56.94 -47.94 79.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.46 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.6 p -70.61 -6.67 38.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.448 0.642 . . . . 0.0 110.839 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 25.9 ttpp -106.66 0.25 24.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.106 -176.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.413 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -74.22 157.39 35.97 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.754 0.787 . . . . 0.0 112.906 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.613 ' H ' HG23 ' A' ' 63' ' ' VAL . 3.6 mppt? -120.65 23.78 10.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.22 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 176.28 -175.06 47.36 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.344 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -99.46 104.99 16.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 117.386 0.593 . . . . 0.0 111.092 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.617 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -111.56 -145.98 10.22 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.42 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.37 145.46 13.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.225 0.61 . . . . 0.0 109.636 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.787 ' HB3' HD23 ' A' ' 59' ' ' LEU . 93.4 m-85 -79.96 140.8 36.49 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.991 175.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.467 HG12 ' HB2' ' A' ' 12' ' ' HIS . 70.0 mt -129.03 125.69 63.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 122.187 -0.321 . . . . 0.0 111.246 -173.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.684 ' HG ' HD12 ' A' ' 35' ' ' ILE . 6.4 mp -73.86 128.35 35.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.023 0.439 . . . . 0.0 111.219 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.504 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 21.1 ttmm -145.72 177.87 8.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.504 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 18.1 mt -108.87 143.41 38.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.374 0.607 . . . . 0.0 112.041 179.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 18.9 ptmt . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.326 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.445 -0.679 0 CA-C-O 121.078 0.466 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.596 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 3.4 p90 -106.13 155.78 19.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -176.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -90.88 137.01 32.69 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.255 -174.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.567 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.2 t -122.49 141.0 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.625 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.548 ' HB3' HD12 ' A' ' 20' ' ' LEU . 45.8 mt-30 -111.43 109.24 19.11 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 165.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.719 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.4 p -135.83 137.9 48.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.776 0.322 . . . . 0.0 111.131 -173.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.405 ' HE2' ' HD3' ' A' ' 100' ' ' LYS . 59.0 m-70 . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 111.195 -177.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.548 HD12 ' HB3' ' A' ' 10' ' ' GLN . 60.1 tp . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 25.7 m -80.14 108.92 14.12 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.197 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.44 114.92 33.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.471 0.653 . . . . 0.0 109.512 177.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.567 HG13 ' HB ' ' A' ' 9' ' ' VAL . 14.1 pt -124.77 174.15 9.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.985 -176.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -124.42 96.88 5.07 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 171.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.87 163.65 17.37 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.7 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.943 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.2 Cg_endo -70.08 144.16 51.47 Favored 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 121.925 1.75 . . . . 0.0 111.99 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.596 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 52.1 mtp180 -61.02 -8.82 3.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.394 0.616 . . . . 0.0 110.729 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -106.99 -5.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.99 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.943 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -56.2 126.64 27.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.55 0.69 . . . . 0.0 110.961 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.525 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -107.1 -179.15 3.85 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.057 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.69 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.56 -48.82 27.69 Favored 'General case' 0 C--O 1.211 -0.934 0 O-C-N 123.484 0.49 . . . . 0.0 111.822 -172.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.626 ' HA ' HD13 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.46 -27.18 63.08 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.864 -177.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.83 -52.41 30.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 122.004 0.907 . . . . 0.0 108.978 176.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.439 ' CG1' HG23 ' A' ' 88' ' ' VAL . 2.7 p -67.38 -26.89 37.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.125 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.69 HG13 ' O ' ' A' ' 31' ' ' ALA . 8.4 mt -55.7 -57.55 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.261 169.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.53 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.0 tt0 -65.45 -32.65 74.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.831 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.445 ' HG2' HD13 ' A' ' 23' ' ' ILE . 45.5 tp60 -61.73 -45.15 95.19 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.165 0.507 . . . . 0.0 110.137 175.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.511 ' HB ' HD23 ' A' ' 103' ' ' LEU . 20.5 m -69.05 -38.39 79.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.89 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -50.65 -42.25 56.28 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.214 0.531 . . . . 0.0 110.67 171.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.36 -46.56 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.505 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -79.92 -19.91 46.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-O 120.878 0.371 . . . . 0.0 110.573 177.658 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.519 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 32.3 m-20 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.241 0.543 . . . . 0.0 111.298 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 11.8 m-85 -116.5 177.85 4.55 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.616 0.722 . . . . 0.0 110.63 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.504 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -148.26 -179.73 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.844 170.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.978 HD13 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -144.27 139.96 28.92 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.604 HD12 HG12 ' A' ' 81' ' ' VAL . 2.3 mm? -104.0 127.86 51.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.896 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.556 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.3 pt-20 -94.3 86.35 4.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.432 1.111 . . . . 0.0 108.39 167.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 0.7 OUTLIER -86.71 123.66 32.12 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.078 175.232 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.544 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -115.64 118.33 58.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.224 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.512 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 84.4 t . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.231 0.539 . . . . 0.0 110.815 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.1 m . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 120.72 0.295 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.4 t -102.54 99.25 9.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 6.0 tt0 -94.97 132.05 40.24 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.028 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -129.22 144.09 51.09 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.604 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -103.78 141.1 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 118.71 0.686 . . . . 0.0 110.928 -178.024 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.639 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 7.8 mt -101.27 156.81 17.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.521 -176.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.42 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.6 mp -86.1 171.83 11.05 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 165.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.47 -31.38 55.62 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -176.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 6.9 pt20 -121.47 33.13 5.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -176.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.639 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 11.7 mm-40 -72.58 -11.74 60.77 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.565 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 55.5 m 68.08 118.61 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.403 0.621 . . . . 0.0 111.931 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.49 ' H ' ' HA ' ' A' ' 30' ' ' THR . 91.7 t -75.78 -37.08 34.76 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.864 -175.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -72.74 -38.78 67.28 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.565 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 18.1 mt-30 -58.36 -45.71 87.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.309 172.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.527 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.35 -50.99 70.7 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.117 178.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.448 ' OE1' ' HE2' ' A' ' 101' ' ' PHE . 12.1 tt0 -59.35 -24.97 63.81 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.674 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -82.93 -9.21 59.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.129 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.527 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 80.3 mttt -86.53 -24.18 25.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.201 0.524 . . . . 0.0 110.538 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -56.16 143.49 33.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.984 -1.007 . . . . 0.0 113.168 -168.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -124.87 20.21 8.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.255 -1.338 . . . . 0.0 108.891 177.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.494 ' O ' HG21 ' A' ' 63' ' ' VAL . . . -168.17 155.22 25.78 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 108.526 -1.83 . . . . 0.0 108.526 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.04 103.92 11.18 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 118.08 0.94 . . . . 0.0 111.256 -176.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.549 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -109.64 -147.66 11.97 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.725 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.405 ' HD3' ' HE2' ' A' ' 12' ' ' HIS . 0.0 OUTLIER -156.01 155.05 32.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.002 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.978 ' HB3' HD13 ' A' ' 59' ' ' LEU . 94.8 m-85 -85.35 151.4 24.05 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 168.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.559 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.5 mp -131.01 125.87 58.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 O-C-N 121.829 -0.544 . . . . 0.0 110.054 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.511 HD23 ' HB ' ' A' ' 38' ' ' THR . 25.0 tp -80.61 133.63 35.78 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -146.93 159.68 43.26 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.549 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.8 OUTLIER -82.89 150.77 26.3 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.634 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.504 ' CA ' HG23 ' A' ' 58' ' ' VAL . 13.2 ptmm? . . . . . 0 C--N 1.315 -0.91 0 CA-C-O 121.453 0.644 . . . . 0.0 109.307 176.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p . . . . . 0 N--CA 1.44 -0.947 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.6 ' HE1' ' HG ' ' A' ' 29' ' ' SER . 7.2 p90 -132.21 152.18 51.44 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -85.86 129.76 34.74 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.023 0.439 . . . . 0.0 111.396 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.551 HG21 ' CE2' ' A' ' 7' ' ' PHE . 2.0 t -118.1 118.03 56.8 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.323 178.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.592 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 80.6 mt-30 -90.56 108.04 19.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 164.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.788 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -121.66 114.33 42.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 121.653 0.74 . . . . 0.0 111.135 -178.888 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.627 ' CD2' HD12 ' A' ' 20' ' ' LEU . 16.7 m-70 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.905 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.627 HD12 ' CD2' ' A' ' 12' ' ' HIS . 41.0 tp . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 21.6 m -85.58 108.45 17.97 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.425 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.4 t -94.22 111.78 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 O-C-N 122.055 -0.403 . . . . 0.0 110.306 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.5 pt -123.15 170.3 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.161 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 tttt -119.16 113.73 21.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.402 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -115.43 168.49 8.22 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.742 -176.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.898 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.6 Cg_endo -75.38 143.46 27.91 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.01 1.807 . . . . 0.0 111.568 -179.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.56 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 67.2 mtt180 -59.31 -18.37 37.27 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.506 0.67 . . . . 0.0 110.495 -176.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.38 -14.34 9.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.137 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.898 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.1 p -55.42 128.52 34.68 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.753 0.787 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.645 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.5 t -111.23 177.55 4.62 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.364 176.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -49.78 -52.77 29.51 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 123.642 0.589 . . . . 0.0 111.306 -171.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.452 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -57.17 -34.92 68.95 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.721 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.47 -52.4 10.78 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.467 0.651 . . . . 0.0 110.523 -175.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.711 HG12 HD21 ' A' ' 59' ' ' LEU . 3.3 p -62.54 -27.62 43.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.064 177.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.719 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.6 mm -56.01 -57.29 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.976 172.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.429 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 10.1 tt0 -71.82 -32.55 67.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -177.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -56.94 -37.77 71.99 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.04 0.448 . . . . 0.0 110.077 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.0 m -70.52 -38.5 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.965 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 35' ' ' ILE . 9.2 mp -54.59 -43.62 72.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.851 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.2 t -71.07 -37.57 72.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.762 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -73.46 -25.43 60.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.885 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.465 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -172.553 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.514 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.2 m-20 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 120.883 0.373 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.582 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 61.1 m-85 -110.4 155.94 21.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 110.832 -177.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.541 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -143.02 146.75 21.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 170.267 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.776 HD23 ' HB3' ' A' ' 101' ' ' PHE . 16.1 tp -99.68 147.8 25.03 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.046 0.451 . . . . 0.0 110.803 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.4 mm? -106.1 133.34 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.594 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HB3' HD22 ' A' ' 82' ' ' LEU . 11.8 pt-20 -94.59 85.23 4.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.706 1.241 . . . . 0.0 108.484 170.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.609 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 14.6 tt0 -86.12 122.86 30.74 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.387 -0.82 . . . . 0.0 109.262 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.523 HG11 ' HB3' ' A' ' 78' ' ' SER . 0.9 OUTLIER -113.36 111.98 38.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-O 121.234 0.54 . . . . 0.0 110.173 176.552 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.622 HG22 ' HA3' ' A' ' 99' ' ' GLY . 79.7 t . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.177 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 57.0 m . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.523 ' HB3' HG11 ' A' ' 63' ' ' VAL . 20.7 t -80.29 99.35 7.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.597 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.25 131.26 40.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.525 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 35.6 ttt-85 -128.35 152.73 47.82 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.52 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.92 144.23 16.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.988 0.813 . . . . 0.0 110.719 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 61' ' ' GLU . 16.9 mt -100.17 158.8 15.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.284 -176.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.8 mp -92.46 -179.19 5.13 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.0 -52.3 34.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.302 0.377 . . . . 0.0 111.337 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.645 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 14.0 pt20 -119.52 51.59 1.15 Allowed 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.6 tp10 -73.12 -21.17 60.78 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.101 0.477 . . . . 0.0 109.738 170.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.672 ' HB2' HE21 ' A' ' 90' ' ' GLN . 54.9 m 73.7 124.98 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.267 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.479 ' H ' ' HA ' ' A' ' 30' ' ' THR . 89.4 t -75.05 -42.94 45.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.521 -173.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 92.9 t80 -73.02 -33.38 65.71 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.672 HE21 ' HB2' ' A' ' 87' ' ' CYS . 14.5 mt-30 -64.12 -41.25 97.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.568 172.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.182 0.515 . . . . 0.0 110.386 176.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -63.39 -28.66 70.14 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.643 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.8 p -78.65 -6.8 56.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.874 0.369 . . . . 0.0 110.934 178.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 34.3 mmtp -88.19 -22.04 24.24 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.302 0.573 . . . . 0.0 109.829 176.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.417 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.5 m0 -62.3 148.29 45.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.866 -173.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.512 ' H ' HG23 ' A' ' 63' ' ' VAL . 95.1 mttt -117.59 13.1 14.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.122 178.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -167.58 173.8 42.64 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.08 100.46 13.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 117.777 0.789 . . . . 0.0 111.208 -176.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.622 ' HA3' HG22 ' A' ' 64' ' ' VAL . . . -104.3 -145.11 13.91 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.997 -178.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.592 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -153.2 153.16 32.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 174.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.788 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.3 m-85 -87.95 122.59 31.75 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 170.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.603 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -101.19 123.61 54.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 O-C-N 121.81 -0.556 . . . . 0.0 110.444 -171.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.589 HD13 HD12 ' A' ' 35' ' ' ILE . 6.0 tp -74.99 127.19 32.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -147.03 170.25 17.53 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.582 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.1 mp -95.98 160.11 14.63 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 175.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.541 ' HB3' HG23 ' A' ' 58' ' ' VAL . 10.9 ptmm? . . . . . 0 C--N 1.31 -1.115 0 CA-C-O 122.11 0.957 . . . . 0.0 109.6 175.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.443 -0.804 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.671 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.3 p90 -137.74 155.04 49.5 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -177.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -90.21 133.74 34.73 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.063 0.459 . . . . 0.0 111.586 -174.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -119.52 121.23 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.274 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.542 ' HB3' HD12 ' A' ' 20' ' ' LEU . 95.9 mt-30 -95.56 108.45 20.7 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 166.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.752 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -125.43 123.44 64.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.393 0.616 . . . . 0.0 111.092 -175.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.551 ' HB2' HG13 ' A' ' 102' ' ' ILE . 63.2 m-70 . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.695 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.542 HD12 ' HB3' ' A' ' 10' ' ' GLN . 58.3 tp . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 120.732 0.301 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.6 m -77.5 144.97 37.3 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 174.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.0 t -125.99 118.08 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.554 HG13 ' HB ' ' A' ' 9' ' ' VAL . 7.3 pt -127.41 169.48 18.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 tttt -120.59 104.16 9.72 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 171.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.553 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -102.35 170.02 6.87 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.792 -175.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.891 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 3.8 Cg_endo -75.75 142.65 25.89 Favored 'Trans proline' 0 N--CA 1.446 -1.321 0 C-N-CA 122.007 1.804 . . . . 0.0 111.302 178.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.671 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 77.9 mtt180 -59.89 -15.62 22.79 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.219 0.533 . . . . 0.0 110.82 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.91 -12.58 8.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.841 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.891 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.9 p -54.69 127.19 27.08 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.63 0.729 . . . . 0.0 110.829 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.686 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.5 t -107.95 -179.08 3.79 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.83 -51.52 29.07 Favored 'General case' 0 C--O 1.212 -0.897 0 O-C-N 123.579 0.549 . . . . 0.0 110.862 -172.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -37.8 69.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -70.7 -53.37 15.89 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 122.234 1.016 . . . . 0.0 109.966 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.646 HG12 HD23 ' A' ' 59' ' ' LEU . 3.0 p -66.05 -27.23 40.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 113.525 -1.67 . . . . 0.0 110.175 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.554 HD12 HD13 ' A' ' 103' ' ' LEU . 3.7 mm -56.12 -57.32 8.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.797 172.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.536 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 4.6 tp-100 -69.25 -33.6 73.5 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.553 HE22 ' HA ' ' A' ' 25' ' ' ALA . 32.6 tt0 -60.41 -42.3 95.72 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.859 0.361 . . . . 0.0 110.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.1 m -67.34 -37.07 82.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.046 174.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.536 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -55.18 -41.9 72.5 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.131 0.491 . . . . 0.0 110.611 172.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.5 t -72.65 -34.28 67.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.886 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -74.3 -39.29 63.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.013 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.473 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -172.147 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.522 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 18.0 m-20 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 120.622 0.248 . . . . 0.0 111.574 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.575 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 43.0 m-85 -111.55 153.64 25.95 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.918 0.39 . . . . 0.0 110.738 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.586 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -140.58 142.69 30.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.059 169.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.646 HD23 HG12 ' A' ' 34' ' ' VAL . 15.8 tp -93.66 145.33 24.63 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.07 0.462 . . . . 0.0 110.412 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.687 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.7 mm? -107.04 129.4 54.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.831 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.672 ' HB3' HD23 ' A' ' 82' ' ' LEU . 15.4 pt-20 -91.13 85.34 5.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.565 1.174 . . . . 0.0 108.283 169.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.63 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 14.3 tt0 -86.29 123.82 31.97 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.632 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.556 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -117.77 116.29 51.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.864 175.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.524 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 95.6 t . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 121.675 0.75 . . . . 0.0 110.385 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 2.0 p . . . . . 0 N--CA 1.445 -0.692 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -75.82 99.03 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.221 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.599 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.8 tt0 -94.49 131.44 40.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -175.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.524 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 3.6 tmt_? -132.93 137.41 46.6 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.517 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -98.05 137.41 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.679 -173.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.695 HD21 ' HG2' ' A' ' 86' ' ' GLU . 11.7 mt -94.04 168.64 10.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.258 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.42 HD11 ' N ' ' A' ' 83' ' ' LEU . 6.4 mp -107.82 -174.38 2.51 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.519 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -47.13 -53.71 12.26 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.397 0.435 . . . . 0.0 111.583 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.686 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 5.7 pt20 -125.25 67.54 1.13 Allowed 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.695 ' HG2' HD21 ' A' ' 82' ' ' LEU . 16.6 tp10 -77.49 -23.97 50.21 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 165.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 72.0 m 75.12 121.44 0.04 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.233 -174.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.478 HG21 ' C ' ' A' ' 30' ' ' THR . 78.2 t -75.2 -40.15 43.49 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-O 121.203 0.525 . . . . 0.0 110.383 -172.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.421 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 87.9 t80 -73.41 -32.73 64.6 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.576 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 12.9 mt-30 -69.82 -33.49 72.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.969 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.39 -43.7 66.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.245 0.545 . . . . 0.0 110.067 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -62.24 -29.44 70.4 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.506 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.8 p -81.02 -4.91 56.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.852 0.358 . . . . 0.0 111.277 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 32.7 mmtp -85.15 -24.18 28.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.435 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.0 m0 -61.74 148.02 44.29 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.41 -169.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -127.47 19.74 6.78 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.238 -1.347 . . . . 0.0 108.818 176.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -161.07 169.93 36.78 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.59 98.8 11.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 118.047 0.923 . . . . 0.0 111.137 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.63 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -110.65 -152.1 12.89 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 119.965 -1.112 . . . . 0.0 112.109 -177.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.522 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.9 mptp? -153.81 155.03 35.06 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.752 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 94.3 m-85 -85.19 126.73 33.89 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.937 -0.705 . . . . 0.0 109.147 171.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.687 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -103.2 124.35 57.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 O-C-N 121.771 -0.581 . . . . 0.0 110.633 -175.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.554 HD13 HD12 ' A' ' 35' ' ' ILE . 8.4 tp -81.84 105.5 13.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 18.5 ttmm -126.09 171.37 10.89 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.5 mp -92.58 162.3 14.24 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.586 ' HB3' HG23 ' A' ' 58' ' ' VAL . 13.7 ptmm? . . . . . 0 C--N 1.313 -1.002 0 CA-C-O 121.925 0.869 . . . . 0.0 109.617 174.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.442 -0.834 0 CA-C-O 121.112 0.482 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.917 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.0 p90 -136.53 153.18 51.08 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -89.05 130.29 35.53 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.331 -175.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.532 HG21 ' CE2' ' A' ' 7' ' ' PHE . 3.3 t -114.5 131.58 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.314 178.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.661 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 80.4 mt-30 -100.68 108.08 19.85 Favored 'General case' 0 N--CA 1.428 -1.557 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 162.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.736 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.06 113.98 40.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.581 ' HB2' HG13 ' A' ' 102' ' ' ILE . 83.2 m-70 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.168 -177.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.549 HD12 ' HB3' ' A' ' 10' ' ' GLN . 54.3 tp . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.554 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 99.6 m -82.14 109.49 16.5 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.703 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.4 t -93.09 111.51 24.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.483 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.5 pt -124.13 175.9 6.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.053 0.454 . . . . 0.0 111.209 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.0 tttt -124.0 110.56 14.93 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.405 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -110.42 169.43 6.36 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.635 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.968 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.2 Cg_endo -74.36 142.52 30.16 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 121.608 1.539 . . . . 0.0 111.382 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.917 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.1 mtt180 -64.53 -1.44 1.79 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.175 0.512 . . . . 0.0 111.279 -175.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 m -112.88 -6.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.95 175.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.968 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.9 p -50.0 139.84 13.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.509 0.671 . . . . 0.0 111.717 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.584 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 4.2 t -118.33 174.05 6.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.328 174.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.555 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.7 -52.02 44.13 Favored 'General case' 0 C--O 1.213 -0.838 0 O-C-N 123.707 0.629 . . . . 0.0 111.183 -171.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -33.81 65.11 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -76.07 -52.54 9.95 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.844 0.83 . . . . 0.0 110.46 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.585 ' CG1' HD23 ' A' ' 59' ' ' LEU . 6.0 p -64.43 -27.28 42.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 114.188 -1.369 . . . . 0.0 110.145 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.556 ' O ' HD12 ' A' ' 39' ' ' LEU . 6.4 mm -56.46 -57.59 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.732 171.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.473 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 4.0 tp-100 -66.97 -34.33 77.52 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.948 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -58.87 -43.02 90.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 120.542 0.211 . . . . 0.0 110.855 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.463 HG23 HD21 ' A' ' 103' ' ' LEU . 15.6 m -68.3 -34.69 76.6 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 35' ' ' ILE . 8.1 mp -54.6 -54.48 40.81 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.234 0.54 . . . . 0.0 110.472 172.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.63 -34.99 79.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.875 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.31 -37.35 87.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.221 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.554 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -171.902 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 1.1 m-20 . . . . . 0 CA--C 1.52 -0.198 0 CA-C-O 121.147 0.499 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.576 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 38.3 m-85 -111.51 160.84 16.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.185 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.515 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -140.44 137.05 36.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.914 168.049 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.617 HD22 ' HB3' ' A' ' 101' ' ' PHE . 22.4 tp -89.94 140.51 29.55 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.205 0.526 . . . . 0.0 110.561 -177.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.549 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.6 mm? -101.67 128.89 47.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.731 178.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 14.3 pt-20 -92.18 84.25 5.21 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.353 1.073 . . . . 0.0 108.302 170.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 20.1 tt0 -86.08 121.86 29.29 Favored 'General case' 0 N--CA 1.425 -1.719 0 O-C-N 120.902 -1.124 . . . . 0.0 109.506 176.536 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.54 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.4 OUTLIER -104.37 104.47 16.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.358 174.059 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.607 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 61.3 t . . . . . 0 N--CA 1.449 -0.508 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.808 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 83.7 p . . . . . 0 N--CA 1.448 -0.549 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.523 ' HB3' HG11 ' A' ' 63' ' ' VAL . 22.7 t -91.0 102.64 15.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.584 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -95.14 131.35 41.25 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.075 0.464 . . . . 0.0 110.226 -175.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.563 ' HD3' ' OE2' ' A' ' 61' ' ' GLU . 32.7 ttt-85 -127.0 151.9 47.96 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.519 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.17 140.14 27.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 118.851 0.75 . . . . 0.0 110.448 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.531 HD13 ' HB3' ' A' ' 59' ' ' LEU . 10.0 mt -93.69 165.5 12.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.551 0.691 . . . . 0.0 111.589 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.0 mp -96.12 -174.38 3.08 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.652 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -53.29 -51.11 63.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.275 0.559 . . . . 0.0 110.798 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.584 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 12.9 pt20 -125.84 55.54 1.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.0 tp10 -73.46 -23.03 60.03 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.668 ' HB2' HE21 ' A' ' 90' ' ' GLN . 7.5 m 76.0 132.15 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.013 -176.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.482 ' H ' ' HA ' ' A' ' 30' ' ' THR . 69.5 t -76.04 -42.81 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-O 121.176 0.512 . . . . 0.0 110.155 -174.584 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -73.0 -33.49 65.81 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.668 HE21 ' HB2' ' A' ' 87' ' ' CYS . 15.8 mt-30 -67.55 -36.79 81.65 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.157 173.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -45.35 70.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.557 0.694 . . . . 0.0 110.344 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.479 HE22 ' HE2' ' A' ' 7' ' ' PHE . 4.8 tt0 -61.7 -32.57 72.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.816 -177.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.5 p -76.24 -16.11 59.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.648 0.261 . . . . 0.0 111.432 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 24.5 mmtp -74.67 -27.31 60.36 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.365 0.603 . . . . 0.0 110.016 176.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -55.68 144.67 26.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.765 -1.107 . . . . 0.0 113.695 -169.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -108.04 14.74 24.93 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.222 -1.354 . . . . 0.0 109.255 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.36 -166.59 30.38 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.607 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -107.46 107.97 19.08 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 117.54 0.67 . . . . 0.0 110.999 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.566 ' HA3' HG21 ' A' ' 64' ' ' VAL . . . -116.68 -147.47 8.73 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.575 -0.822 . . . . 0.0 111.777 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.661 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -152.05 160.46 43.44 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 173.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.736 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 85.9 m-85 -88.87 123.91 33.69 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 169.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.581 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.8 mp -103.07 121.97 54.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 121.952 -0.468 . . . . 0.0 110.188 -175.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.543 ' CD1' HD11 ' A' ' 35' ' ' ILE . 7.8 tp -79.31 112.07 16.18 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -131.39 168.88 16.83 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.576 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 2.1 mp -91.53 161.17 15.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 14.3 ptmm? . . . . . 0 C--N 1.312 -1.027 0 CA-C-O 121.762 0.792 . . . . 0.0 109.486 174.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.413 ' HB2' ' HE2' ' A' ' 24' ' ' LYS . 17.4 m . . . . . 0 N--CA 1.45 -0.473 0 CA-C-O 121.296 0.569 . . . . 0.0 109.938 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.881 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.0 p90 -114.4 157.31 23.04 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -87.95 133.73 33.87 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.002 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.517 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -118.69 129.56 74.76 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.442 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.573 ' HB3' HD12 ' A' ' 20' ' ' LEU . 79.7 mt-30 -96.97 108.03 20.67 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 163.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.706 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.88 118.95 56.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.33 0.586 . . . . 0.0 110.499 178.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.558 ' HB2' HG13 ' A' ' 102' ' ' ILE . 29.1 m-70 . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.935 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 10' ' ' GLN . 45.0 tp . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.614 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 50.6 m -83.36 108.05 16.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.419 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 56.5 t -95.65 111.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.517 HG13 ' HB ' ' A' ' 9' ' ' VAL . 12.8 pt -120.69 175.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.0 111.323 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.413 ' HE2' ' HB2' ' A' ' 6' ' ' SER . 39.8 tttt -122.87 120.15 32.64 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 170.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.417 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -126.74 167.88 16.15 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -171.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.907 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.2 Cg_exo -68.2 139.59 46.63 Favored 'Trans proline' 0 N--CA 1.442 -1.52 0 C-N-CA 121.293 1.329 . . . . 0.0 111.429 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.881 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 42.3 mtt180 -66.72 -0.86 3.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.233 0.539 . . . . 0.0 110.701 -177.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.2 m -112.26 -9.1 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.979 174.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.907 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.5 p -46.45 139.59 4.85 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.891 0.853 . . . . 0.0 112.724 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.512 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 4.3 t -116.35 174.74 5.89 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.264 172.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.19 -50.79 48.28 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 123.579 0.55 . . . . 0.0 111.576 -171.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -34.63 70.1 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.43 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.33 -52.38 16.45 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.043 0.925 . . . . 0.0 110.084 -176.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.865 HG12 HD21 ' A' ' 59' ' ' LEU . 8.0 p -65.09 -27.94 43.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.261 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.693 HG12 ' O ' ' A' ' 31' ' ' ALA . 7.2 mm -56.77 -58.97 3.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.378 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.45 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 10.2 tt0 -73.77 -32.49 63.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.509 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.7 -42.72 84.31 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 120.781 0.324 . . . . 0.0 110.156 174.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.3 m -66.32 -38.06 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.017 175.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.558 HD12 ' O ' ' A' ' 35' ' ' ILE . 7.8 mp -53.5 -44.25 68.9 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.804 173.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.1 t -63.19 -34.14 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.258 0.551 . . . . 0.0 111.026 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -80.48 -21.58 41.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.216 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -172.905 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.513 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 60.5 m-20 . . . . . 0 CA--C 1.517 -0.302 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 42.2 m-85 -113.09 151.9 30.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.066 0.46 . . . . 0.0 111.1 -175.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.494 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -138.8 142.92 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.765 170.732 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.865 HD21 HG12 ' A' ' 34' ' ' VAL . 19.6 tp -94.57 142.56 27.31 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.015 0.436 . . . . 0.0 110.014 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.553 ' CD1' HG12 ' A' ' 81' ' ' VAL . 2.1 mm? -106.45 125.06 50.52 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.633 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.638 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -88.62 85.47 6.82 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 122.505 1.145 . . . . 0.0 108.351 171.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.536 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 1.8 tm-20 -87.14 121.73 29.99 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.581 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -109.51 112.4 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.464 176.184 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.625 HG21 ' HA3' ' A' ' 99' ' ' GLY . 61.1 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.343 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.504 ' HB3' HG11 ' A' ' 63' ' ' VAL . 26.9 t -82.23 100.19 9.73 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.536 ' HG2' HD11 ' A' ' 60' ' ' LEU . 7.3 tt0 -93.47 131.49 38.64 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.582 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 30.7 ttt-85 -126.35 150.44 48.55 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.553 HG12 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.48 144.21 16.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 118.979 0.809 . . . . 0.0 110.328 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.544 HD13 ' HB3' ' A' ' 59' ' ' LEU . 15.7 mt -101.62 149.64 23.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.872 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.416 HD13 ' N ' ' A' ' 83' ' ' LEU . 6.2 mp -83.26 172.31 12.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.599 171.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -48.02 -48.98 32.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.221 0.534 . . . . 0.0 110.983 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.462 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 19.0 pt20 -119.52 38.84 3.76 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.17 -176.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.55 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.1 tp10 -71.01 -21.83 62.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.986 0.422 . . . . 0.0 109.923 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.606 ' HB2' HE21 ' A' ' 90' ' ' GLN . 43.8 m 76.14 125.22 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.962 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.512 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.2 t -76.39 -39.41 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.078 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -72.88 -33.93 66.36 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.606 HE21 ' HB2' ' A' ' 87' ' ' CYS . 14.9 mt-30 -67.11 -30.05 69.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.958 174.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.66 -42.58 50.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.342 0.591 . . . . 0.0 110.397 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -56.78 -37.67 71.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.742 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 71.7 p -72.39 -13.9 61.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.818 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -78.1 -27.73 48.49 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 110.588 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.44 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.1 m0 -55.69 139.24 45.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -166.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -109.59 14.12 23.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.787 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.84 176.13 45.04 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.747 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.69 99.08 10.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.692 0.746 . . . . 0.0 110.857 -177.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.625 ' HA3' HG21 ' A' ' 64' ' ' VAL . . . -106.97 -148.8 15.32 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.963 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.482 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.7 mptp? -150.15 155.61 40.11 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.711 ' HB3' HD23 ' A' ' 59' ' ' LEU . 99.2 m-85 -84.58 120.78 26.75 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 169.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.558 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -102.07 127.37 55.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.846 -0.534 . . . . 0.0 110.356 -174.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.414 HD13 HD12 ' A' ' 35' ' ' ILE . 8.9 tp -81.19 120.87 25.42 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.529 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.3 ttmm -140.63 175.64 9.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.2 mp -98.47 156.47 16.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.494 ' HB3' HG23 ' A' ' 58' ' ' VAL . 19.2 ptmt . . . . . 0 C--N 1.312 -1.037 0 CA-C-O 122.092 0.949 . . . . 0.0 110.245 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.444 -0.734 0 CA-C-O 121.169 0.509 . . . . 0.0 109.972 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.558 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.3 p90 -104.3 150.0 24.84 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -80.53 120.67 24.81 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.189 -174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' HG13 ' A' ' 23' ' ' ILE . 19.1 t -107.06 135.53 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.424 175.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.548 ' HB3' HD13 ' A' ' 20' ' ' LEU . 56.9 mt-30 -112.69 109.04 18.3 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 165.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.718 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -131.49 122.82 51.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.112 -175.461 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.548 ' CD2' HD12 ' A' ' 20' ' ' LEU . 42.3 m-70 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.811 -176.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.548 HD13 ' HB3' ' A' ' 10' ' ' GLN . 51.9 tp . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.8 m -75.19 109.51 8.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.278 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -94.73 115.75 34.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.552 HG13 ' HB ' ' A' ' 9' ' ' VAL . 1.6 pt -130.97 130.06 63.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.363 -177.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -84.5 96.05 9.0 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -107.28 162.15 20.69 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.336 -173.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.87 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.6 Cg_exo -65.29 144.76 81.75 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.747 1.631 . . . . 0.0 112.158 -171.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.558 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 18.7 mtp180 -60.22 -11.28 5.9 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.609 0.719 . . . . 0.0 110.214 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.87 -4.41 9.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.46 177.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.87 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.8 p -58.33 124.6 20.05 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.495 0.664 . . . . 0.0 110.777 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.532 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.7 t -106.06 177.88 4.73 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.261 172.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.709 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.63 -50.33 24.72 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 123.564 0.54 . . . . 0.0 111.938 -171.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.608 ' HA ' HD13 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.44 -27.56 63.35 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.634 -176.385 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.88 -49.34 53.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.895 0.855 . . . . 0.0 109.158 178.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 31' ' ' ALA . 2.3 p -69.18 -27.65 35.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.941 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.709 HG13 ' O ' ' A' ' 31' ' ' ALA . 12.2 mt -56.64 -57.69 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.459 170.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.51 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 36.3 tt0 -66.1 -32.19 73.5 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.866 -176.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -59.44 -45.91 90.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-O 121.373 0.606 . . . . 0.0 109.686 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.4 m -64.82 -39.59 93.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.081 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.2 mp -50.79 -43.79 58.77 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.063 0.459 . . . . 0.0 110.828 173.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 86.0 m -63.46 -43.95 95.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.749 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -79.64 -16.41 55.83 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.582 0 CA-C-O 120.503 0.192 . . . . 0.0 111.089 179.3 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.0 m-20 . . . . . 0 N--CA 1.463 0.224 0 CA-C-O 121.117 0.484 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 16.4 m-85 -104.54 175.32 5.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.352 0.596 . . . . 0.0 110.189 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.568 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -144.28 180.0 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.339 169.838 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 1.023 HD12 ' HB3' ' A' ' 101' ' ' PHE . 1.7 tm? -144.19 137.51 27.45 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 -176.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.611 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.49 127.33 46.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.82 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.2 pt-20 -93.21 84.24 4.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.476 1.132 . . . . 0.0 108.549 169.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.618 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 7.3 tt0 -86.0 123.35 31.23 Favored 'General case' 0 N--CA 1.426 -1.659 0 O-C-N 121.624 -0.672 . . . . 0.0 109.956 176.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.524 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -113.77 116.13 51.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.086 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.629 HG22 ' HA3' ' A' ' 99' ' ' GLY . 97.4 t . . . . . 0 C--N 1.325 -0.47 0 CA-C-O 121.29 0.567 . . . . 0.0 110.601 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.515 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 50.4 m . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.711 0.291 . . . . 0.0 110.771 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.9 t -87.27 98.66 11.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 7.6 tt0 -97.7 131.67 44.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.726 -174.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.522 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 2.3 tmt_? -128.04 148.7 50.56 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.544 HG12 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.63 133.77 51.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 118.665 0.666 . . . . 0.0 111.005 -177.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.648 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 9.3 mt -93.14 166.61 12.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.394 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.439 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.7 mp -95.49 -176.8 3.88 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 165.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -59.67 -32.61 70.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.532 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 6.3 pt20 -125.28 38.58 4.15 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -176.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.648 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 13.3 mm-40 -75.38 -12.7 60.31 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.019 171.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.618 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 63.6 m 68.95 121.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.445 0.64 . . . . 0.0 111.943 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.511 ' H ' ' HA ' ' A' ' 30' ' ' THR . 74.9 t -75.75 -39.79 39.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.183 -173.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -72.58 -38.22 67.94 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.618 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 12.1 mt-30 -58.27 -46.77 85.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.51 172.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.18 -46.84 87.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.729 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -60.56 -26.98 67.32 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.181 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 t -75.12 -20.71 59.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -77.13 -23.12 51.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.361 0.6 . . . . 0.0 110.311 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.404 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.7 m0 -60.47 133.37 56.03 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.427 -172.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -113.16 11.85 18.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.695 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -156.77 167.78 33.73 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 109.081 -1.608 . . . . 0.0 109.081 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.77 105.65 17.94 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 118.02 0.91 . . . . 0.0 110.702 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.629 ' HA3' HG22 ' A' ' 64' ' ' VAL . . . -110.52 -142.84 9.4 Favored Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.586 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.473 ' HG3' ' C ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -158.1 160.32 37.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.104 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 1.023 ' HB3' HD12 ' A' ' 59' ' ' LEU . 95.8 m-85 -89.35 151.87 21.83 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 169.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.611 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.9 mp -132.69 128.89 58.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 O-C-N 121.933 -0.479 . . . . 0.0 110.465 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.428 HD13 HG12 ' A' ' 35' ' ' ILE . 12.8 tp -84.1 136.8 33.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -154.27 165.31 36.72 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.553 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -89.04 149.78 23.07 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 169.71 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.568 ' CA ' HG23 ' A' ' 58' ' ' VAL . 13.2 ptmm? . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.172 0.51 . . . . 0.0 109.947 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 p . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.1 p90 -130.2 149.8 51.74 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -89.42 138.31 31.56 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.858 -177.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.446 HG21 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -126.49 158.09 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.092 0.472 . . . . 0.0 109.888 176.265 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.52 ' HB2' HD13 ' A' ' 20' ' ' LEU . 5.2 pm0 -129.63 107.46 9.46 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 163.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.53 HG11 ' HB2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -118.36 139.63 44.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.727 -174.692 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 . . . . . 0 C--N 1.315 -0.918 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.031 178.229 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 10' ' ' GLN . 40.4 tp . . . . . 0 N--CA 1.447 -0.588 0 CA-C-O 121.004 0.431 . . . . 0.0 111.054 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.8 m -95.96 106.85 19.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.768 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.8 t -85.08 120.64 35.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.2 pt -130.92 168.73 23.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.891 0.377 . . . . 0.0 110.783 -177.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -124.87 111.93 16.05 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -117.92 164.73 18.53 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.002 -175.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.688 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 5.8 Cg_exo -68.23 143.91 60.67 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 122.203 1.936 . . . . 0.0 111.993 -179.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 44.7 mtp180 -64.81 -3.64 3.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.532 0.682 . . . . 0.0 110.449 -176.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.406 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.8 m -109.43 -7.9 11.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.109 177.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.688 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 0.8 OUTLIER -55.62 123.18 13.22 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 121.484 0.659 . . . . 0.0 111.875 174.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.652 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.2 t -100.47 178.91 4.6 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.96 170.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.507 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.34 -51.4 19.59 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.607 0.567 . . . . 0.0 111.238 -172.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.488 HE21 ' CA ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -61.89 -32.05 72.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -177.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.64 -52.19 16.41 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.787 0.803 . . . . 0.0 109.368 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.406 ' CG1' HD21 ' A' ' 59' ' ' LEU . 2.3 p -66.91 -29.29 45.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.064 -178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.849 HD12 ' HG ' ' A' ' 103' ' ' LEU . 5.7 mm -56.93 -58.39 5.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.086 172.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.434 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.2 tt0 -68.51 -32.04 71.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.699 -175.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.5 ' O ' ' HG2' ' A' ' 41' ' ' LYS . 6.3 tp60 -63.8 -37.4 87.25 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 120.985 0.422 . . . . 0.0 109.976 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 27.7 m -70.53 -36.03 73.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.88 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.9 mp -55.45 -36.57 66.7 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.445 0.641 . . . . 0.0 110.375 172.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.9 m -70.45 -38.58 74.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.105 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 75.1 mmtt -71.02 -28.09 64.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.788 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.557 -179.375 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.635 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.172 0 CA-C-O 121.041 0.448 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.519 ' HB3' HD11 ' A' ' 35' ' ' ILE . 6.7 m-85 -106.77 137.9 43.94 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.227 -176.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.62 HG21 ' O ' ' A' ' 104' ' ' LYS . 0.8 OUTLIER -118.83 165.71 13.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 165.827 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 101' ' ' PHE . 13.9 tp -117.89 138.46 52.11 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.526 HD12 ' HA ' ' A' ' 81' ' ' VAL . 2.6 mm? -98.51 126.08 43.95 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.693 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.1 pt-20 -88.66 86.43 6.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.584 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 10.8 tt0 -86.98 121.93 30.12 Favored 'General case' 0 N--CA 1.423 -1.817 0 O-C-N 120.702 -1.249 . . . . 0.0 108.733 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.493 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.4 OUTLIER -106.03 115.84 48.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 CA-C-O 121.425 0.631 . . . . 0.0 109.366 174.742 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.711 HG22 ' HA3' ' A' ' 99' ' ' GLY . 53.4 t . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.217 -176.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.45 -0.449 0 CA-C-O 120.87 0.367 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.475 ' HB2' HG11 ' A' ' 63' ' ' VAL . 20.3 m -104.27 103.06 12.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 16.2 tt0 -95.77 130.78 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -175.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -132.06 131.38 42.37 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.526 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -88.92 137.18 21.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.446 -173.885 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 17.9 mt -97.37 159.96 14.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.707 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.595 ' H ' ' HG3' ' A' ' 86' ' ' GLU . 7.7 mp -86.92 -169.63 2.71 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 165.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.11 -36.12 82.31 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.695 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.652 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 3.4 pt20 -125.11 44.6 2.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.595 ' HG3' ' H ' ' A' ' 83' ' ' LEU . 8.1 mm-40 -77.33 -9.66 58.97 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 122.174 -0.329 . . . . 0.0 110.875 172.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.649 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 16.7 t 74.41 129.32 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.088 0.955 . . . . 0.0 111.415 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.542 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.6 t -78.54 -46.85 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 109.778 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -72.41 -41.4 66.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.505 -174.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.649 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 8.7 mm-40 -63.26 -45.0 93.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.658 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.99 -51.26 69.95 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 110.493 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -55.49 -36.51 66.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.125 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.5 t -72.25 -15.73 61.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.454 -177.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 68.4 mmtt -90.9 -13.01 34.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.329 0.585 . . . . 0.0 110.737 -178.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 42.1 m0 -59.01 152.35 20.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.177 -174.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.452 ' H ' HG22 ' A' ' 63' ' ' VAL . 3.3 mppt? -109.05 15.79 23.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.422 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -179.91 176.38 47.41 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 114.618 -1.174 . . . . 0.0 110.603 -176.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.483 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -94.38 106.63 18.61 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.512 0.656 . . . . 0.0 110.925 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.711 ' HA3' HG22 ' A' ' 64' ' ' VAL . . . -106.89 -146.76 13.48 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.073 -177.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -149.39 137.66 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.53 ' HB2' HG11 ' A' ' 11' ' ' VAL . 98.0 m-85 -84.34 146.31 27.78 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.521 -0.872 . . . . 0.0 109.324 169.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.521 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 71.3 mt -135.61 129.61 49.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 O-C-N 122.079 -0.388 . . . . 0.0 111.587 -171.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.849 ' HG ' HD12 ' A' ' 35' ' ' ILE . 9.1 mp -79.61 107.93 12.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 110.009 174.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.62 ' O ' HG21 ' A' ' 58' ' ' VAL . 32.2 ttpt -138.26 128.86 26.45 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.562 HD21 ' O ' ' A' ' 56' ' ' ASP . 19.3 mt -62.32 139.72 58.52 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.624 0.726 . . . . 0.0 112.895 -171.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.9 ptmm? . . . . . 0 C--N 1.313 -0.988 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.481 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.49 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.794 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.545 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.534 ' HB3' HD12 ' A' ' 20' ' ' LEU . 45.8 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.791 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.63 ' HE2' ' HD3' ' A' ' 100' ' ' LYS . 78.2 m-70 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.534 HD12 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.486 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.545 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.858 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.794 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' A' ' 26' ' ' PRO . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.858 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.547 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.674 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.589 ' HA ' HD13 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.456 ' CG1' HG22 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.674 HG13 ' O ' ' A' ' 31' ' ' ALA . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.532 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.532 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 37.2 m-20 . . . . . 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.556 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.581 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 1.016 HD12 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.712 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.641 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.535 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.534 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.862 0.363 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.599 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.501 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.545 HG12 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.635 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.49 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.547 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.623 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.53 HG13 ' HZ ' ' A' ' 7' ' ' PHE . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.623 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 0.9 OUTLIER -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.515 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.439 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.481 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.641 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.63 ' HD3' ' HE2' ' A' ' 12' ' ' HIS . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 1.016 ' HB3' HD12 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.712 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.556 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.581 ' CA ' HG23 ' A' ' 58' ' ' VAL . 9.2 ptmm? . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.561 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 11.6 m . . . . . 0 N--CA 1.445 -0.683 0 N-CA-C 109.109 -0.701 . . . . 0.0 109.109 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.644 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 9.2 p90 -135.76 149.53 49.19 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -83.77 121.48 27.36 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.303 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.524 ' HB ' HG13 ' A' ' 23' ' ' ILE . 9.2 t -99.78 128.73 51.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.056 0.455 . . . . 0.0 110.38 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.506 ' HG3' HD13 ' A' ' 20' ' ' LEU . 8.7 tt0 -100.16 106.59 18.31 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 166.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.662 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -135.47 137.16 50.13 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.242 -176.383 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 . . . . . 0 C--N 1.321 -0.656 0 N-CA-C 112.127 0.418 . . . . 0.0 112.127 -173.344 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.506 HD13 ' HG3' ' A' ' 10' ' ' GLN . 46.1 tp . . . . . 0 N--CA 1.449 -0.489 0 CA-C-O 120.68 0.276 . . . . 0.0 110.626 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.3 m -104.06 110.26 22.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.193 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.8 p -99.75 128.29 51.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.301 0.572 . . . . 0.0 109.637 173.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.524 HG13 ' HB ' ' A' ' 9' ' ' VAL . 9.1 pt -137.66 159.97 34.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.696 -178.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HE3' ' HB2' ' A' ' 6' ' ' SER . 18.8 tttp -114.48 97.8 6.52 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.45 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -110.31 169.31 6.5 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.055 -170.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.88 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.5 Cg_endo -71.9 140.1 34.44 Favored 'Trans proline' 0 N--CA 1.443 -1.442 0 C-N-CA 121.48 1.453 . . . . 0.0 110.612 -176.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.644 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 98.9 mtt180 -57.72 -36.48 72.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.8 -13.94 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 113.944 -1.48 . . . . 0.0 112.617 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.88 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 80.1 p -58.45 124.76 20.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.679 0.752 . . . . 0.0 110.757 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.557 ' CB ' ' HA ' ' A' ' 87' ' ' CYS . 2.2 t -100.66 179.63 4.36 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.927 171.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.647 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.51 -50.39 23.55 Favored 'General case' 0 C--O 1.209 -1.068 0 O-C-N 123.422 0.451 . . . . 0.0 110.745 -174.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.405 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.4 OUTLIER -59.69 -31.91 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -72.8 -53.35 11.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 122.168 0.985 . . . . 0.0 109.641 -176.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.644 HG12 HD21 ' A' ' 59' ' ' LEU . 2.6 p -65.42 -27.7 42.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.074 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.745 HD12 HD11 ' A' ' 103' ' ' LEU . 10.1 mm -56.74 -56.07 16.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.363 168.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.839 ' HA ' HD11 ' A' ' 39' ' ' LEU . 25.2 tp60 -59.98 -45.49 92.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.941 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -59.1 -39.17 81.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.649 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.508 ' HB ' HD12 ' A' ' 103' ' ' LEU . 29.5 m -69.02 -41.13 78.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.73 0.3 . . . . 0.0 110.293 176.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.839 HD11 ' HA ' ' A' ' 36' ' ' GLN . 29.7 mt -56.8 -38.84 73.11 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 120.986 0.422 . . . . 0.0 110.308 175.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.03 -52.98 44.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.783 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -80.34 -9.26 59.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 O-C-N 122.396 -0.19 . . . . 0.0 111.097 179.789 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.52 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.7 m-20 . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 110.522 -0.177 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.563 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 49.5 m-85 -123.24 143.92 49.73 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.397 0.618 . . . . 0.0 111.799 -175.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 106' ' ' LYS . 3.1 m -127.66 165.99 25.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.411 166.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.644 HD21 HG12 ' A' ' 34' ' ' VAL . 12.2 tp -112.59 152.02 29.38 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.887 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.6 OUTLIER -109.3 140.19 43.28 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.042 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.678 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.1 pt-20 -105.58 87.14 2.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.117 0.961 . . . . 0.0 109.096 170.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.624 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.1 tt0 -86.58 123.72 32.09 Favored 'General case' 0 N--CA 1.42 -1.939 0 O-C-N 121.19 -0.944 . . . . 0.0 109.376 173.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.551 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -111.82 117.59 55.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.564 HG22 ' HA3' ' A' ' 99' ' ' GLY . 92.7 t . . . . . 0 CA--C 1.514 -0.406 0 CA-C-O 121.601 0.715 . . . . 0.0 109.313 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.451 -0.41 0 CA-C-O 121.418 0.627 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.7 m -102.96 100.0 9.93 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.605 171.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 43.1 tt0 -94.33 132.69 38.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.942 -174.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.586 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 6.2 tpp180 -127.73 160.71 30.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.767 HG12 HD12 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -115.71 144.71 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 118.381 0.537 . . . . 0.0 110.474 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.656 HD22 ' HB3' ' A' ' 61' ' ' GLU . 20.8 mt -104.84 152.07 23.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.672 -174.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.3 mp -81.36 169.67 16.94 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 166.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -41.39 62.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.9 0.381 . . . . 0.0 111.389 -176.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.528 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 14.1 pt20 -114.09 32.03 6.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.571 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 22.6 tp10 -63.39 -20.69 65.75 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.992 0.425 . . . . 0.0 110.331 175.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 73.9 m 72.09 122.27 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.208 178.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.515 ' H ' ' HA ' ' A' ' 30' ' ' THR . 90.9 t -75.27 -38.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.25 -171.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -72.92 -33.96 66.29 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.564 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.1 OUTLIER -65.43 -40.57 93.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.192 176.781 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.526 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -68.88 -40.32 79.32 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.687 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.63 -36.03 79.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.135 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -70.51 -15.36 62.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.545 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.526 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 88.6 mttt -75.55 -24.98 56.75 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.011 0.434 . . . . 0.0 110.434 177.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.407 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.1 m0 -63.68 153.95 34.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -167.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mtmm -135.81 24.99 3.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.176 -1.375 . . . . 0.0 108.205 175.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.47 ' O ' HG21 ' A' ' 63' ' ' VAL . . . -169.28 153.5 22.12 Favored Glycine 0 N--CA 1.44 -1.055 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.37 10.59 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.283 1.041 . . . . 0.0 111.062 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.564 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -106.38 -154.35 20.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.894 -176.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HZ3' ' CD ' ' A' ' 62' ' ' GLU . 1.3 mtmt -146.32 143.88 29.43 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.662 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -80.42 153.06 28.5 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 169.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 92.9 mt -135.57 128.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 O-C-N 122.02 -0.425 . . . . 0.0 111.426 -173.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.745 HD11 HD12 ' A' ' 35' ' ' ILE . 3.4 tp -77.7 130.46 36.82 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.115 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.462 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 1.1 tppt? -151.61 175.79 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.7 mp -101.92 133.33 46.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.86 0.362 . . . . 0.0 110.416 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.464 ' HB3' HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.873 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.074 173.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.7 p . . . . . 0 N--CA 1.446 -0.655 0 CA-C-O 121.219 0.533 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.844 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -124.14 156.7 36.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.214 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.448 ' CZ ' ' HE2' ' A' ' 24' ' ' LYS . 43.7 m-85 -84.75 125.22 32.36 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.22 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.566 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.9 t -113.76 129.32 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.457 178.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.547 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 44.9 mt-30 -97.96 108.54 21.28 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 164.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.761 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -120.08 115.19 46.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-O 121.51 0.672 . . . . 0.0 110.406 177.831 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.561 ' HB2' HG13 ' A' ' 102' ' ' ILE . 9.4 m-70 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.266 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.538 HD12 ' CD2' ' A' ' 12' ' ' HIS . 27.0 tp . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.57 0.224 . . . . 0.0 110.489 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.57 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.6 m -92.06 109.45 20.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 173.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 50.0 t -95.81 110.69 24.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.566 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.2 pt -116.68 168.28 8.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.891 0.377 . . . . 0.0 110.706 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HE2' ' CZ ' ' A' ' 8' ' ' PHE . 19.0 tttm -117.1 96.05 5.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 169.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.4 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -100.47 167.49 10.82 Favored Pre-proline 0 CA--C 1.506 -0.712 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.461 -175.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.884 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 5.6 Cg_exo -68.74 141.98 51.27 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 121.535 1.49 . . . . 0.0 111.523 -177.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.844 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 35.5 mtp180 -66.33 -0.45 2.64 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.601 0.715 . . . . 0.0 109.966 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.451 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.5 m -114.12 -2.44 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.461 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.884 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.2 p -59.86 119.69 8.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.277 0.561 . . . . 0.0 109.859 175.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.48 ' C ' HG21 ' A' ' 88' ' ' VAL . 17.8 p -94.15 -173.82 3.21 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.525 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -55.8 -49.92 71.89 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.711 -176.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.423 HE21 ' CA ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -61.92 -30.71 71.08 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -178.817 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -70.68 -53.74 14.54 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.485 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.2 p -66.59 -27.6 40.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 113.599 -1.637 . . . . 0.0 110.135 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 31' ' ' ALA . 4.3 mm -55.88 -58.15 5.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.584 174.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.553 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 54.7 mt-30 -73.28 -32.77 64.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.752 0.31 . . . . 0.0 110.894 -175.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -60.99 -37.3 81.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-O 120.775 0.322 . . . . 0.0 110.216 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.591 ' HA ' ' HB3' ' A' ' 41' ' ' LYS . 32.6 m -75.68 -30.18 59.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.272 175.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 5.9 mp -55.68 -47.93 75.91 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-O 120.961 0.41 . . . . 0.0 109.943 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.8 m -67.16 -37.21 83.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.542 0.687 . . . . 0.0 110.161 176.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.591 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 27.9 tptp -69.86 -10.28 57.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.069 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.262 -179.742 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 CA--C 1.512 -0.51 0 CA-C-O 120.545 0.212 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.52 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 20.8 m-85 -118.54 134.45 55.08 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.259 0.552 . . . . 0.0 112.149 -171.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.527 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -108.69 178.8 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.445 163.158 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 1.101 HD13 ' HB3' ' A' ' 101' ' ' PHE . 3.0 tm? -131.04 132.84 45.21 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -98.83 125.97 44.35 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.546 -175.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.0 pt-20 -88.74 86.0 6.89 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.36 1.076 . . . . 0.0 108.508 170.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.602 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 17.9 tt0 -85.53 122.66 29.98 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.525 -0.735 . . . . 0.0 109.145 175.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.561 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.3 OUTLIER -115.61 117.92 57.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 121.449 0.642 . . . . 0.0 110.08 176.194 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.537 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 59.3 t . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.016 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.537 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 6.8 p . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 121.153 0.502 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.1 m -82.16 104.93 12.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.489 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.552 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 18.5 tt0 -94.34 131.21 40.21 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -176.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.493 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 29.4 ttt180 -126.68 149.85 49.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.513 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -105.8 139.5 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.822 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.669 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 23.6 mt -96.86 156.89 16.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.306 0.574 . . . . 0.0 111.578 -176.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.446 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 47.2 mt -76.98 168.45 20.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 162.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.16 -40.13 64.08 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -120.73 35.69 4.8 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.695 0.283 . . . . 0.0 111.669 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.669 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 23.9 tp10 -65.57 -17.68 64.76 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.6 ' HB2' HE21 ' A' ' 90' ' ' GLN . 18.9 m 78.2 109.48 0.07 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.521 176.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.48 HG21 ' C ' ' A' ' 30' ' ' THR . 86.8 t -55.71 -45.84 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.332 173.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -73.72 -35.54 65.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.66 -175.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.6 HE21 ' HB2' ' A' ' 87' ' ' CYS . 18.1 mt-30 -62.31 -45.37 93.56 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 173.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.24 90.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.677 177.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -54.41 -47.35 72.86 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.81 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.7 t -75.29 -4.44 39.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 0.0 110.466 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -99.35 -6.69 27.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.963 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.457 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -72.59 161.12 31.19 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.724 0.773 . . . . 0.0 112.541 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -128.77 21.59 5.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.02 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -178.0 169.59 41.5 Favored Glycine 0 N--CA 1.44 -1.078 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.248 -178.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.465 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -88.58 102.96 15.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 117.347 0.574 . . . . 0.0 111.376 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.602 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -111.09 -149.18 11.57 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.422 -0.894 . . . . 0.0 111.898 177.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.547 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.4 mptp? -152.61 155.01 36.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 1.101 ' HB3' HD13 ' A' ' 59' ' ' LEU . 99.4 m-85 -86.91 116.73 25.17 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 173.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.561 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -101.46 122.91 54.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 O-C-N 122.013 -0.429 . . . . 0.0 110.365 -173.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.497 ' CD1' HD12 ' A' ' 35' ' ' ILE . 7.5 tp -74.2 135.52 42.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -160.81 149.39 16.41 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.624 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.52 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 10.9 mp -70.39 141.68 52.15 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.204 174.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.527 ' CA ' HG23 ' A' ' 58' ' ' VAL . 14.3 ptpt . . . . . 0 C--N 1.317 -0.825 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.907 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p . . . . . 0 N--CA 1.444 -0.737 0 CA-C-O 120.904 0.383 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.537 ' CD1' ' HA ' ' A' ' 27' ' ' ARG . 6.0 p90 -147.87 155.46 41.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.488 ' CZ ' ' HD2' ' A' ' 24' ' ' LYS . 65.7 m-85 -87.08 129.61 34.84 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.188 -175.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' HG13 ' A' ' 23' ' ' ILE . 22.1 t -109.09 131.34 60.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.087 0.47 . . . . 0.0 110.767 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.672 ' HG2' ' HG2' ' A' ' 100' ' ' LYS . 28.2 tt0 -101.57 106.49 17.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 166.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.593 ' HB ' ' HB2' ' A' ' 101' ' ' PHE . 1.8 p -139.57 137.89 39.82 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-O 120.883 0.373 . . . . 0.0 111.337 -172.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.578 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 94.0 m-70 . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.975 0.417 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.522 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 87.8 m -98.24 121.15 39.82 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.05 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.1 t -110.82 111.33 35.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 0.0 109.846 176.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.555 HG13 ' HB ' ' A' ' 9' ' ' VAL . 2.5 pt -124.12 159.83 29.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.298 -178.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.488 ' HD2' ' CZ ' ' A' ' 8' ' ' PHE . 1.4 ttpm? -109.95 96.55 6.31 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 171.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.69 163.67 18.03 Favored Pre-proline 0 CA--C 1.504 -0.82 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.929 -175.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.974 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.3 Cg_exo -68.42 145.91 66.69 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.704 1.603 . . . . 0.0 110.974 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.537 ' HA ' ' CD1' ' A' ' 7' ' ' PHE . 73.6 mtt180 -62.02 -15.69 46.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.781 0.801 . . . . 0.0 109.634 -178.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.3 m -98.13 -4.59 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.3 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.974 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.7 p -55.72 123.25 13.52 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.786 0.803 . . . . 0.0 110.476 178.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.556 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 1.0 OUTLIER -103.53 174.61 5.79 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.991 173.246 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.594 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.15 -51.19 18.85 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 123.522 0.514 . . . . 0.0 111.331 -173.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.2 tp60 -60.92 -31.6 71.12 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.463 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -78.76 -51.86 9.19 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 -177.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.429 ' CG1' ' HG ' ' A' ' 59' ' ' LEU . 2.9 p -60.55 -28.54 42.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.765 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.64 HD12 ' HG ' ' A' ' 103' ' ' LEU . 5.8 mm -56.45 -57.86 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.052 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.511 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 28.4 tt0 -70.76 -32.37 69.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.201 -174.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -60.87 -38.01 84.11 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.978 0.418 . . . . 0.0 110.251 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.5 m -71.01 -31.92 68.56 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.078 175.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.511 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -62.42 -33.7 75.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.409 0.623 . . . . 0.0 110.806 173.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t -78.24 -36.74 46.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.812 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -70.98 -50.33 35.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.216 0.531 . . . . 0.0 110.179 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.023 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 8.1 m-20 . . . . . 0 CA--C 1.515 -0.388 0 CA-C-O 121.025 0.441 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.582 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 47.0 m-85 -107.62 156.52 18.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.093 -177.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.585 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.38 169.21 21.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 167.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 1.074 HD12 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -123.0 139.62 53.89 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -174.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.649 HD12 HG12 ' A' ' 81' ' ' VAL . 1.0 OUTLIER -103.11 128.63 49.96 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.017 -177.207 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HG3' ' HB3' ' A' ' 80' ' ' ARG . 9.4 pt-20 -92.94 87.3 5.73 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.037 0.922 . . . . 0.0 108.96 171.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 9.7 tt0 -85.7 123.3 30.93 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.554 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.37 116.66 52.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t . . . . . 0 C--N 1.317 -0.814 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.309 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.565 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 19.8 m . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 m -92.97 103.9 16.18 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.2 tt0 -94.85 131.29 40.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.892 0.377 . . . . 0.0 110.217 -174.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.668 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 38.8 ttm180 -127.2 158.12 37.96 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.649 HG12 HD12 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -112.62 144.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 118.355 0.525 . . . . 0.0 110.819 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.534 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 19.8 mt -100.01 -177.07 3.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.31 0.576 . . . . 0.0 111.524 -176.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.748 ' H ' ' HB3' ' A' ' 86' ' ' GLU . 17.1 mt -117.62 -170.83 1.94 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.962 -179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.44 -30.66 71.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.164 0.507 . . . . 0.0 109.874 175.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.404 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 4.2 pt20 -129.69 19.78 5.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -177.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.748 ' HB3' ' H ' ' A' ' 83' ' ' LEU . 13.7 tp10 -79.27 80.82 5.6 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 123.085 1.421 . . . . 0.0 107.771 169.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.62 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 58.1 m -35.63 135.45 0.28 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-N 110.257 -3.156 . . . . 0.0 113.68 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.507 ' H ' ' HA ' ' A' ' 30' ' ' THR . 55.3 t -76.16 -41.47 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.468 -175.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -72.44 -33.99 67.46 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.62 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 1.6 mt-30 -64.37 -42.19 96.3 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.299 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.55 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -63.19 -45.75 90.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.681 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -59.63 -29.72 68.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.693 -178.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.1 p -76.95 -20.69 55.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.343 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.55 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 75.1 mttt -73.02 -30.0 63.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.37 0.605 . . . . 0.0 110.209 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.437 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -49.09 128.84 17.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.872 -167.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.535 ' H ' HG22 ' A' ' 63' ' ' VAL . 22.4 mtpp -97.21 20.11 11.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.043 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 179.16 -171.56 43.55 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.595 -177.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -103.14 111.25 23.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.772 0.786 . . . . 0.0 110.768 178.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 63' ' ' VAL . . . -116.45 -149.28 9.2 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.12 -177.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.672 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 2.0 mtmt -151.11 145.53 25.53 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 1.074 ' HB3' HD12 ' A' ' 59' ' ' LEU . 98.0 m-85 -79.2 154.22 29.41 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.577 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 67.3 mt -142.93 129.62 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 O-C-N 121.679 -0.638 . . . . 0.0 111.65 -174.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.64 ' HG ' HD12 ' A' ' 35' ' ' ILE . 5.8 mp -73.36 141.54 47.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.902 0.382 . . . . 0.0 110.98 176.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.521 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 9.3 tppt? -154.06 176.29 12.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.582 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.0 mp -101.28 142.57 32.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.164 0.507 . . . . 0.0 110.05 174.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.585 ' CA ' HG23 ' A' ' 58' ' ' VAL . 16.9 ptmt . . . . . 0 C--N 1.311 -1.07 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.008 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.03 0.443 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 p 179.37 -160.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.53 -33.34 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -72.7 125.76 28.27 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.838 173.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.474 ' OE2' ' HD2' ' A' ' 27' ' ' ARG . 29.3 tt0 -104.82 141.12 37.07 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.21 -170.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.49 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m -91.01 133.33 35.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 168.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.794 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.545 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.534 ' HB3' HD12 ' A' ' 20' ' ' LEU . 45.8 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.791 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.63 ' HE2' ' HD3' ' A' ' 100' ' ' LYS . 78.2 m-70 -77.26 143.52 38.85 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -135.48 170.22 16.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.483 ' CG2' HD13 ' A' ' 48' ' ' ILE . 10.4 m -86.24 -1.08 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-O 120.632 0.253 . . . . 0.0 111.584 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -62.48 128.89 92.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.984 0.421 . . . . 0.0 110.295 172.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.7 170.48 19.92 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.024 2.483 . . . . 0.0 113.011 -176.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 18' ' ' GLN . 11.8 tp10 61.43 94.2 0.04 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.927 -175.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.448 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 13.2 mm-40 66.33 76.52 0.29 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.146 -170.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.21 -32.1 93.96 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.677 2.251 . . . . 0.0 111.195 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.534 HD12 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp -80.8 106.45 12.81 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.618 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.486 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.545 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.858 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.794 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' A' ' 26' ' ' PRO . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.858 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.547 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.674 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.589 ' HA ' HD13 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.456 ' CG1' HG22 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.674 HG13 ' O ' ' A' ' 31' ' ' ALA . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.532 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.532 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -116.07 16.77 16.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.842 ' HA ' HD22 ' A' ' 49' ' ' LEU . 36.2 ttmt -62.45 110.15 1.58 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.237 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.488 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 32.8 m-85 70.7 -12.32 0.56 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.579 1.152 . . . . 0.0 112.142 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 43' ' ' LYS . 15.4 m -54.72 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -178.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -99.05 6.78 46.45 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.464 ' C ' ' H ' ' A' ' 49' ' ' LEU . 30.3 t 57.45 42.72 24.16 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.275 -176.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.483 HD13 ' CG2' ' A' ' 14' ' ' VAL . 22.5 mm -63.52 -9.6 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.832 171.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.842 HD22 ' HA ' ' A' ' 43' ' ' LYS . 1.3 mm? -73.24 9.51 1.25 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.102 -1.408 . . . . 0.0 111.557 -171.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -59.94 -32.41 70.77 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -120.55 86.01 39.0 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.78 7.05 3.34 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.275 1.983 . . . . 0.0 113.012 -172.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.426 HD21 ' HB2' ' A' ' 55' ' ' SER . 5.7 p-10 -113.77 136.84 22.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.929 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.425 ' HB3' ' HB2' ' A' ' 36' ' ' GLN . 65.6 Cg_endo -75.61 7.51 3.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.122 2.548 . . . . 0.0 112.869 -175.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.437 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 4.2 m -88.23 -13.2 41.62 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.864 -174.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 37.2 m-20 -109.94 15.02 22.87 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 -176.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.556 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.581 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 1.016 HD12 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.712 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.641 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.535 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.534 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t -67.72 112.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HB3' ' HE3' ' A' ' 65' ' ' LYS . 24.7 mmmt -123.12 95.13 4.49 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.788 -1.096 . . . . 0.0 108.973 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.552 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 6.8 p-10 -60.77 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.402 -175.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.8 t -122.93 114.32 20.28 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.389 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 m -69.61 -36.62 76.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.212 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -87.02 -152.37 0.19 Allowed 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' HB3' ' HE2' ' A' ' 70' ' ' LYS . 48.3 mtpt -113.81 81.51 1.54 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.199 0.523 . . . . 0.0 110.975 173.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -104.76 -31.57 9.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.602 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.437 HG23 ' H ' ' A' ' 74' ' ' THR . 14.5 m -139.33 143.87 38.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.386 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -64.61 -19.73 65.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.0 111.215 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.437 ' H ' HG23 ' A' ' 72' ' ' THR . 7.3 p -137.8 160.42 64.84 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.859 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.7 133.61 45.03 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.277 1.985 . . . . 0.0 111.598 172.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.552 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 21.3 pttp -112.87 164.92 12.82 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.61 -168.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m -113.63 139.98 48.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.008 -177.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.599 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.501 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.633 HG13 HG23 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.635 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.49 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.547 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.623 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.53 HG13 ' HZ ' ' A' ' 7' ' ' PHE . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.623 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 0.9 OUTLIER -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.515 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.439 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.481 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.641 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.63 ' HD3' ' HE2' ' A' ' 12' ' ' HIS . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 1.016 ' HB3' HD12 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.712 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.556 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.581 ' CA ' HG23 ' A' ' 58' ' ' VAL . 9.2 ptmm? -84.95 -19.69 31.77 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.67 -13.43 60.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.562 168.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -103.15 -8.87 20.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.307 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.633 HG23 HG13 ' A' ' 81' ' ' VAL . 0.5 OUTLIER -101.21 7.72 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.08 176.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -50.73 89.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 113.529 -168.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.27 18.04 0.48 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.285 -1.325 . . . . 0.0 107.991 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.5 t -104.81 60.61 0.69 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.861 -172.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 60.31 -92.53 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.328 175.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -147.97 143.52 27.36 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.445 ' CG ' ' HZ2' ' A' ' 106' ' ' LYS . 32.2 t70 -113.86 -39.83 3.9 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.932 0.396 . . . . 0.0 110.754 -176.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.5 pttp . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.198 -177.274 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 t -75.08 121.73 22.49 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -81.8 78.65 8.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.708 0.766 . . . . 0.0 111.397 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.85 160.98 20.03 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.92 171.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -102.48 108.29 19.55 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.526 0.679 . . . . 0.0 111.378 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 p -139.95 137.77 35.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.76 175.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.759 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 12.5 p90 -113.8 154.77 26.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.061 -175.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -87.2 129.81 34.81 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 111.333 -176.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.5 t -115.73 127.82 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.348 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.549 ' HB3' HD12 ' A' ' 20' ' ' LEU . 34.6 mt-30 -102.05 107.09 18.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.774 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.6 OUTLIER -130.22 130.67 65.77 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.709 -174.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -74.63 138.67 43.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.466 -175.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.495 ' HB2' ' HG1' ' A' ' 21' ' ' THR . 18.1 t70 -93.81 178.83 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.602 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.6 t -91.25 -23.95 5.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.885 0.374 . . . . 0.0 110.575 -178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.7 t -97.95 142.79 25.13 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.894 0.378 . . . . 0.0 110.586 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 15' ' ' SER . 23.6 Cg_exo -64.81 -22.76 63.28 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.957 3.104 . . . . 0.0 114.755 -170.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -67.08 -19.55 65.67 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.057 -0.402 . . . . 0.0 111.523 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -124.01 78.41 58.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-O 120.907 0.384 . . . . 0.0 110.02 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.6 -37.66 28.15 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.542 2.161 . . . . 0.0 110.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.549 HD12 ' HB3' ' A' ' 10' ' ' GLN . 56.4 tp -134.71 103.21 5.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.172 174.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.628 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 29.7 m -82.09 109.44 16.41 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.341 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.12 111.22 24.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.923 0.392 . . . . 0.0 109.979 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.551 HG13 ' HB ' ' A' ' 9' ' ' VAL . 17.7 pt -122.36 173.25 8.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.778 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -122.03 97.61 5.56 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.22 160.28 30.16 Favored Pre-proline 0 CA--C 1.504 -0.795 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.755 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.86 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.8 Cg_exo -66.01 141.83 65.81 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 121.848 1.699 . . . . 0.0 111.386 -177.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.759 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 38.0 mtp180 -63.69 -0.57 1.03 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.609 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.47 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.6 m -114.35 -9.96 12.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.642 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.86 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.6 p -53.86 133.45 42.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 110.935 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 21.4 p -96.81 -169.99 1.97 Allowed 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.485 ' HA ' HG11 ' A' ' 88' ' ' VAL . . . -59.03 -48.55 81.19 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.248 178.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.504 ' NE2' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -57.45 -32.59 67.09 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 123.15 0.281 . . . . 0.0 111.398 -178.67 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -74.44 -53.74 8.96 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 122.245 1.022 . . . . 0.0 109.94 -176.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.668 HG12 HG12 ' A' ' 88' ' ' VAL . 5.1 p -65.95 -27.47 41.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.126 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.807 HD11 HD11 ' A' ' 103' ' ' LEU . 3.1 mm -56.07 -58.22 5.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.141 171.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 28.2 tt0 -72.45 -32.33 66.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.293 -175.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -59.47 -35.26 73.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 122.106 -0.371 . . . . 0.0 110.683 176.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.9 m -68.89 -41.09 78.75 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 9.7 mp -54.13 -40.88 67.8 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.653 172.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.8 t -67.81 -33.31 74.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.468 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -73.18 -32.73 65.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.397 0.618 . . . . 0.0 109.972 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.436 ' HB2' ' HB ' ' A' ' 48' ' ' ILE . . . -97.91 26.15 5.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.423 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.443 ' HA ' HD23 ' A' ' 49' ' ' LEU . 14.0 tptp -80.6 99.46 8.13 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.324 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.405 ' HD2' ' HG3' ' A' ' 43' ' ' LYS . 79.7 m-85 68.52 3.62 3.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.487 0.715 . . . . 0.0 112.915 177.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.9 m -64.26 -70.43 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.055 0.455 . . . . 0.0 110.51 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -111.97 14.82 20.87 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.372 -0.974 . . . . 0.0 108.372 172.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.2 t 59.37 92.13 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 113.702 -1.59 . . . . 0.0 111.351 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.436 ' HB ' ' HB2' ' A' ' 42' ' ' ALA . 2.0 tt -102.22 0.06 10.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 122.027 0.918 . . . . 0.0 108.975 175.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 43' ' ' LYS . 48.6 mt -84.05 34.63 0.51 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.591 -162.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 p -68.35 -33.28 73.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 168.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -122.17 86.43 47.27 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.211 168.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.58 4.08 5.86 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.546 2.164 . . . . 0.0 111.677 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.475 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.7 p-10 -110.97 135.15 20.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.961 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.607 ' HB3' HG21 ' A' ' 35' ' ' ILE . 2.5 Cg_endo -81.68 6.58 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.746 2.297 . . . . 0.0 112.013 -179.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.505 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 6.1 m -71.3 -29.91 65.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.808 -173.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -97.5 8.87 43.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.985 0.421 . . . . 0.0 110.985 -176.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 29.9 m-85 -109.89 150.15 28.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.183 0.516 . . . . 0.0 111.098 -177.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.602 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -126.06 160.33 33.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.675 168.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 1.015 HD13 ' HB3' ' A' ' 101' ' ' PHE . 1.2 tm? -116.78 135.03 54.07 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.834 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.8 OUTLIER -98.41 130.71 45.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.09 -176.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.655 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.8 pt-20 -96.93 91.11 5.46 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.435 1.112 . . . . 0.0 108.52 169.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.649 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 3.3 tt0 -88.21 123.03 32.43 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 121.227 -0.921 . . . . 0.0 109.705 172.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.5 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -112.45 117.46 55.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.316 0.579 . . . . 0.0 109.564 169.836 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.651 HG22 ' HA3' ' A' ' 99' ' ' GLY . 51.8 t -86.5 118.76 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.21 -176.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -110.71 90.5 3.34 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 168.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.556 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 3.7 p-10 -71.02 -97.86 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.3 -169.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.437 ' H ' ' CG ' ' A' ' 66' ' ' ASP . 1.9 t -157.92 88.78 0.98 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.604 0.716 . . . . 0.0 110.312 176.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 p -82.33 26.74 0.53 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.791 -177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.464 ' HB2' ' H ' ' A' ' 70' ' ' LYS . 1.2 m-80 -120.79 -85.26 0.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.67 0.747 . . . . 0.0 109.222 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.797 ' HA ' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -128.73 -142.7 0.26 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.691 177.244 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.415 ' H ' ' HB3' ' A' ' 70' ' ' LYS . 3.1 tppp? -94.55 64.53 3.06 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 171.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.411 ' C ' ' HG1' ' A' ' 73' ' ' THR . 23.3 m -79.66 100.94 8.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.989 -175.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.411 ' HG1' ' C ' ' A' ' 72' ' ' THR . 41.2 p 51.4 -117.95 1.19 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.468 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.0 p -127.35 151.1 74.25 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.06 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.556 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 80.8 Cg_exo -53.07 136.91 62.27 Favored 'Trans proline' 0 CA--C 1.514 -0.51 0 C-N-CA 122.797 2.332 . . . . 0.0 111.734 171.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -106.27 98.28 7.98 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.377 -171.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.7 p -79.82 103.91 10.04 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.509 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.9 m -83.86 96.94 8.94 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 176.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.61 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.0 tt0 -97.79 131.7 44.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.879 -0.601 . . . . 0.0 109.993 -175.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.556 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 24.5 ttt180 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.754 HG12 HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -110.35 140.55 28.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.482 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.5 mt -100.89 150.11 23.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.215 0.531 . . . . 0.0 111.653 -174.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.36 156.36 38.45 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 162.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.16 -32.99 38.37 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.811 0.338 . . . . 0.0 111.738 -175.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -110.38 19.64 18.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.8 -9.56 45.38 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.835 178.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 85.4 m 68.44 106.73 0.05 Allowed 'General case' 0 C--O 1.219 -0.537 0 O-C-N 123.931 0.769 . . . . 0.0 111.471 175.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.668 HG12 HG12 ' A' ' 34' ' ' VAL . 17.0 m -72.34 -32.08 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.159 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -73.47 -37.19 65.86 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 118.881 -1.128 . . . . 0.0 109.042 178.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.62 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 57.4 mt-30 -62.0 -45.74 92.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.84 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.8 -44.03 81.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.74 -37.58 76.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.049 -178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 65.1 p -76.28 -11.99 60.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.835 0.35 . . . . 0.0 111.318 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.62 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 86.5 mttt -82.91 -21.8 34.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.228 0.537 . . . . 0.0 109.705 177.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.437 ' CG ' ' HB ' ' A' ' 63' ' ' VAL . 43.4 m0 -64.34 157.77 25.33 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.719 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -137.7 19.23 2.87 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.174 175.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -160.6 165.61 35.11 Favored Glycine 0 N--CA 1.441 -0.978 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.415 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -86.76 104.76 16.45 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 117.99 0.895 . . . . 0.0 110.816 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.651 ' HA3' HG22 ' A' ' 64' ' ' VAL . . . -107.76 -147.61 13.47 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.147 -1.025 . . . . 0.0 112.147 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -150.43 153.93 36.81 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 176.136 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 1.015 ' HB3' HD13 ' A' ' 59' ' ' LEU . 96.8 m-85 -87.0 154.74 20.54 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 166.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.834 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 4.9 mp -135.18 127.18 47.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 121.66 -0.65 . . . . 0.0 110.951 -178.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.807 HD11 HD11 ' A' ' 35' ' ' ILE . 7.6 tp -83.14 127.53 33.68 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.591 ' HG2' ' CG2' ' A' ' 109' ' ' VAL . 5.6 tppt? -149.11 175.82 11.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.1 mp -98.17 144.17 27.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 0.0 110.491 172.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.602 ' CA ' HG23 ' A' ' 58' ' ' VAL . 9.2 ptmt -85.31 -21.82 28.79 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.166 -176.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -83.83 4.73 27.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.424 0.63 . . . . 0.0 110.392 174.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -121.78 -38.15 2.78 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.591 ' CG2' ' HG2' ' A' ' 104' ' ' LYS . 57.3 t -88.7 75.21 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 164.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -90.81 9.52 29.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.153 -174.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.14 8.72 12.27 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.896 171.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 15.2 m -92.81 -0.19 57.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.346 -178.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -101.26 88.59 3.52 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.317 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -77.73 81.9 4.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.618 0.723 . . . . 0.0 109.146 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -89.06 178.46 6.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.507 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.995 -176.384 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.442 ' H2 ' HG23 ' A' ' 28' ' ' VAL . 7.7 m . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 120.696 0.284 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t -145.04 157.98 43.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.241 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -80.25 -5.94 57.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.594 0.235 . . . . 0.0 111.059 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -84.6 3.04 38.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.396 0.617 . . . . 0.0 110.256 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -136.44 115.18 12.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.209 176.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.401 ' OG ' ' HE2' ' A' ' 24' ' ' LYS . 57.1 p -157.3 155.16 30.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.322 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.627 ' CD1' ' HA ' ' A' ' 27' ' ' ARG . 6.9 p90 -148.66 153.5 38.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -90.9 128.25 36.69 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.505 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.548 HG21 ' CE2' ' A' ' 7' ' ' PHE . 2.6 t -108.97 125.66 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.254 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.604 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 84.1 mt-30 -93.61 107.38 19.24 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.771 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -124.14 115.69 45.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.429 0.633 . . . . 0.0 110.576 -178.353 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.573 ' HB2' HG13 ' A' ' 102' ' ' ILE . 45.0 m-70 -69.68 145.48 52.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.601 -175.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.89 167.03 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.53 -21.57 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.387 0.613 . . . . 0.0 109.613 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.2 m -75.67 160.7 78.54 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.222 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.49 ' O ' ' HB3' ' A' ' 17' ' ' GLU . 61.1 Cg_endo -73.81 -144.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.627 2.218 . . . . 0.0 111.822 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' PRO . 8.0 tp10 71.66 -64.26 0.39 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.524 ' HB3' ' HH ' ' A' ' 46' ' ' TYR . 6.6 tp60 -155.06 96.85 2.48 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -52.84 -35.53 70.4 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.037 2.491 . . . . 0.0 112.446 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.549 HD11 ' CD2' ' A' ' 12' ' ' HIS . 52.7 tp -105.04 96.42 6.52 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 34.1 m -71.43 108.95 5.1 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.202 -176.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.4 t -96.14 111.06 25.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.4 pt -118.8 176.51 3.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.701 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.401 ' HE2' ' OG ' ' A' ' 6' ' ' SER . 51.4 tttt -124.9 97.75 5.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.44 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -98.86 170.98 6.22 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.138 -176.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.883 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.8 Cg_endo -75.64 140.8 24.14 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 C-N-CA 122.165 1.91 . . . . 0.0 110.14 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.627 ' HA ' ' CD1' ' A' ' 7' ' ' PHE . 90.7 mtt180 -54.24 -42.92 70.43 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.442 HG23 ' H2 ' ' A' ' 1' ' ' SER . 16.9 m -68.63 -10.37 13.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.951 178.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.883 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 85.9 p -57.02 128.77 38.66 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.422 0.63 . . . . 0.0 110.783 177.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -102.3 179.19 4.38 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 171.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.773 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.42 -50.3 31.61 Favored 'General case' 0 C--O 1.213 -0.865 0 O-C-N 123.297 0.373 . . . . 0.0 111.013 -174.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.83 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -56.35 -35.45 67.65 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.96 -52.97 11.15 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.935 0.874 . . . . 0.0 110.021 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.797 HG12 HD23 ' A' ' 59' ' ' LEU . 5.3 p -63.13 -27.44 43.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.89 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.773 HG12 ' O ' ' A' ' 31' ' ' ALA . 3.5 mm -55.75 -58.26 5.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.128 173.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.482 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 6.3 tp-100 -69.39 -33.63 73.31 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.024 -177.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.44 HE22 ' HA ' ' A' ' 25' ' ' ALA . 17.6 tt0 -65.52 -36.67 84.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.48 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.2 m -70.52 -35.62 73.27 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.561 HD11 ' O ' ' A' ' 35' ' ' ILE . 6.9 mp -54.44 -46.21 73.22 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.443 171.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.06 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -79.95 -23.3 41.79 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.777 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.501 ' HA ' ' CD1' ' A' ' 46' ' ' TYR . . . -101.66 -18.84 15.67 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -172.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.58 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -56.8 115.58 2.66 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.03 -179.104 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.776 ' HA ' HD23 ' A' ' 49' ' ' LEU . 84.1 m-85 68.42 -43.45 0.49 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.496 1.118 . . . . 0.0 111.461 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.437 ' H ' ' C ' ' A' ' 43' ' ' LYS . 35.1 m -49.9 -61.14 2.31 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.108 0.963 . . . . 0.0 111.927 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.524 ' HH ' ' HB3' ' A' ' 18' ' ' GLN . 2.7 m-85 -95.69 15.43 20.07 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 46.59 37.4 4.46 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 114.259 -1.337 . . . . 0.0 111.489 -170.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.428 ' O ' HD12 ' A' ' 49' ' ' LEU . 30.6 mm -86.23 85.55 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.103 173.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.776 HD23 ' HA ' ' A' ' 44' ' ' TYR . 2.7 mm? -124.92 -7.56 7.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.483 -178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -66.53 -43.41 85.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.407 . . . . 0.0 110.531 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.03 90.25 48.7 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.564 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -86.19 -1.49 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.047 2.498 . . . . 0.0 111.793 176.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -95.45 127.71 40.96 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.482 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.83 ' HB2' HE22 ' A' ' 32' ' ' GLN . 83.9 Cg_endo -80.45 2.02 8.82 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.9 2.4 . . . . 0.0 112.6 -175.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 p -77.08 -32.23 56.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.139 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 15.5 m-20 -88.78 -2.32 58.53 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.446 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 50.0 m-85 -103.69 152.94 21.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.482 0.658 . . . . 0.0 111.425 -175.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.616 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -136.03 161.89 37.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 168.621 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.797 HD23 HG12 ' A' ' 34' ' ' VAL . 21.1 tp -115.29 148.39 39.26 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.484 -0.487 . . . . 0.0 109.98 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.689 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.3 mm? -106.44 134.56 49.39 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.797 ' HB3' HD22 ' A' ' 82' ' ' LEU . 12.6 pt-20 -98.87 87.34 3.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 122.378 1.085 . . . . 0.0 108.665 170.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.613 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 0.4 OUTLIER -87.07 124.47 33.26 Favored 'General case' 0 N--CA 1.414 -2.255 0 O-C-N 121.656 -0.652 . . . . 0.0 109.757 174.73 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.576 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.6 OUTLIER -113.86 111.25 35.21 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.422 174.054 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 92.5 t -59.17 105.21 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 121.389 0.614 . . . . 0.0 110.046 174.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.504 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.6 mmmt -110.0 102.45 11.18 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.06 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.42 145.42 11.35 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.713 171.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.453 HG23 ' HZ2' ' A' ' 76' ' ' LYS . 4.9 t -139.89 15.88 2.48 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.9 m -57.74 -61.84 2.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.33 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 54.63 -89.38 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.404 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -105.0 -45.17 4.61 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.749 -167.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.598 ' HZ3' ' HB2' ' A' ' 71' ' ' LYS . 3.8 ttmp? -104.33 164.17 11.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.333 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.423 ' N ' ' HG2' ' A' ' 71' ' ' LYS . 24.1 m -67.46 96.71 0.53 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.324 0.583 . . . . 0.0 109.977 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -137.58 133.84 34.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.714 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 p -66.32 144.48 98.73 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.465 -176.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.11 151.32 73.61 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.867 2.378 . . . . 0.0 112.314 177.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.453 ' HZ2' HG23 ' A' ' 67' ' ' THR . 50.2 mttp -109.99 175.32 5.48 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.727 -176.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.6 p -134.41 110.79 9.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.029 0.443 . . . . 0.0 109.876 176.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.509 ' HB3' HG11 ' A' ' 63' ' ' VAL . 11.9 t -87.6 99.28 11.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 6.9 tt0 -94.93 131.69 40.58 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.273 -0.422 . . . . 0.0 109.927 -175.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.639 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 27.1 ttt180 -126.72 157.57 38.74 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.883 HG13 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -111.99 144.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 118.482 0.583 . . . . 0.0 110.104 177.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.934 HD23 ' HG2' ' A' ' 86' ' ' GLU . 16.5 mt -103.17 154.64 19.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.237 0.541 . . . . 0.0 111.575 -173.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.403 HD11 ' N ' ' A' ' 83' ' ' LEU . 6.7 mp -87.24 176.0 7.77 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.758 170.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -47.27 -51.31 19.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.463 0.477 . . . . 0.0 111.475 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -115.03 41.64 2.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.934 ' HG2' HD23 ' A' ' 82' ' ' LEU . 14.1 tp10 -62.34 -28.46 69.77 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.597 ' HB2' HE21 ' A' ' 90' ' ' GLN . 22.9 m 73.21 122.04 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.482 -175.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.463 ' H ' ' HA ' ' A' ' 30' ' ' THR . 94.0 t -74.68 -36.97 42.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.024 -173.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' A' ' 27' ' ' ARG . 86.7 t80 -73.39 -34.3 65.46 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.597 HE21 ' HB2' ' A' ' 87' ' ' CYS . 13.8 mt-30 -64.92 -44.73 88.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.87 175.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.912 ' HA ' ' HZ3' ' A' ' 94' ' ' LYS . . . -62.9 -46.69 86.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.039 0.447 . . . . 0.0 110.452 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -56.16 -38.8 71.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.372 -178.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.7 p -74.3 -5.01 39.64 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.912 ' HZ3' ' HA ' ' A' ' 91' ' ' ALA . 10.8 mttp -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.2 0.524 . . . . 0.0 110.643 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -64.41 155.36 32.77 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.871 -173.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.425 ' H ' HG23 ' A' ' 63' ' ' VAL . 98.8 mttt -130.8 18.34 5.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.13 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -163.7 166.79 37.53 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 109.278 -1.529 . . . . 0.0 109.278 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.31 93.27 8.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 118.018 0.909 . . . . 0.0 111.088 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.595 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -100.98 -150.23 23.97 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.206 -0.997 . . . . 0.0 112.024 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -151.89 155.56 38.35 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 175.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.771 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.5 m-85 -86.52 124.48 32.88 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.689 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -102.17 122.09 54.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.801 -0.562 . . . . 0.0 110.397 -174.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.9 tp -75.29 135.49 40.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.412 ' HE2' ' HB2' ' A' ' 104' ' ' LYS . 16.5 ttmm -156.86 176.6 12.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 6.6 mp -104.19 143.98 32.21 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.616 ' CA ' HG23 ' A' ' 58' ' ' VAL . 12.1 ptmm? -69.62 -23.52 63.52 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.186 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.794 ' HA ' ' HG2' ' A' ' 110' ' ' GLN . 28.5 mt-10 -83.3 -12.92 56.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.534 177.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.478 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 82.4 mt-30 -94.58 -16.29 23.36 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.883 HG12 HG13 ' A' ' 81' ' ' VAL . 64.4 t -105.21 12.3 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 114.345 -1.298 . . . . 0.0 109.863 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.794 ' HG2' ' HA ' ' A' ' 107' ' ' GLU . 16.7 mm-40 -63.52 167.76 5.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.468 173.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.09 72.41 0.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.585 0.707 . . . . 0.0 110.153 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 64.3 m -87.24 166.82 14.63 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.125 -171.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 113' ' ' ARG . 56.5 mmt-85 -118.87 102.82 9.07 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 67.14 -71.35 0.1 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.014 0.821 . . . . 0.0 110.026 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.91 124.36 10.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 171.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm . . . . . 0 N--CA 1.466 0.343 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.7 -178.666 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.872 0.368 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 m -96.52 27.41 3.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.767 -176.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 47.71 56.58 6.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.938 -167.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -35.45 114.77 0.27 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.974 177.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -105.1 144.22 32.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.409 -0.814 . . . . 0.0 113.08 -164.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.3 p -119.19 147.81 43.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.109 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.923 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.4 p90 -116.51 152.49 33.97 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.415 ' CE2' ' HD3' ' A' ' 24' ' ' LYS . 69.4 m-85 -89.42 131.8 35.3 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.445 -175.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.438 HG21 ' CE2' ' A' ' 7' ' ' PHE . 1.8 t -122.33 155.85 27.25 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 176.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.405 ' HB2' HD13 ' A' ' 20' ' ' LEU . 5.1 pm0 -129.46 107.3 9.38 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 163.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.631 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -115.04 140.07 38.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.477 -176.77 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -88.42 128.67 35.53 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.863 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -102.09 154.79 18.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.61 75.5 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.34 0.591 . . . . 0.0 110.399 -177.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 33.3 p -157.8 146.41 14.4 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.271 178.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 15' ' ' SER . 7.4 Cg_exo -74.5 -159.31 0.09 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.866 2.377 . . . . 0.0 112.584 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 71.22 -60.51 0.51 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.84 0.856 . . . . 0.0 110.392 -173.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.441 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.4 tp60 -143.25 100.15 5.32 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.98 -22.19 62.88 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.442 2.761 . . . . 0.0 113.532 -172.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.405 HD13 ' HB2' ' A' ' 10' ' ' GLN . 58.9 tp -107.99 137.33 46.17 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.257 -0.277 . . . . 0.0 110.362 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.461 HG23 HG21 ' A' ' 23' ' ' ILE . 20.7 m -112.1 107.94 17.05 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.506 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.3 t -86.43 111.06 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.462 HG23 ' HG3' ' A' ' 41' ' ' LYS . 9.9 pt -125.34 119.09 54.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.957 0.408 . . . . 0.0 111.779 -176.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HD3' ' CE2' ' A' ' 8' ' ' PHE . 21.3 ttpp -79.8 118.51 21.65 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.59 161.84 56.67 Favored Pre-proline 0 C--N 1.318 -0.801 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.669 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 7.5 Cg_exo -62.75 142.51 89.35 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 121.915 1.743 . . . . 0.0 111.907 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.923 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 46.4 mtp180 -63.51 -1.2 1.11 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.49 0.662 . . . . 0.0 110.015 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.485 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.4 m -107.9 -11.71 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.204 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.669 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 2.9 m -54.69 124.04 15.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.729 0.776 . . . . 0.0 112.826 176.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.636 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 1.8 t -98.33 177.47 5.36 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.545 171.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.529 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.35 -51.43 26.27 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.44 0.462 . . . . 0.0 111.362 -172.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.409 HE21 ' CA ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -64.82 -31.59 72.89 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.081 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -42.95 43.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 110.152 -176.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.515 ' CG1' HG23 ' A' ' 88' ' ' VAL . 1.3 p -72.5 -29.2 30.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.696 176.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 31' ' ' ALA . 5.9 mm -56.51 -57.33 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 171.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.473 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 26.7 tt0 -64.5 -31.43 72.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.934 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 34' ' ' VAL . 6.2 tp60 -63.44 -40.79 98.09 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.145 0.498 . . . . 0.0 109.765 175.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 m -67.92 -32.09 72.3 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.693 175.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.473 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.8 mp -61.61 -33.75 74.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.189 0.519 . . . . 0.0 110.727 173.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.6 m -68.9 -39.4 79.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.063 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.462 ' HG3' HG23 ' A' ' 23' ' ' ILE . 74.5 mmtt -78.74 -49.81 12.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.876 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.46 83.75 5.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.716 0.769 . . . . 0.0 109.657 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.568 ' HD2' ' HB2' ' A' ' 44' ' ' TYR . 5.2 tmmm? -148.9 129.37 13.9 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.525 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.962 ' HA ' HD23 ' A' ' 49' ' ' LEU . 6.1 t80 74.51 -35.4 0.3 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 123.892 0.745 . . . . 0.0 110.55 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 43' ' ' LYS . 6.8 t -67.5 125.44 26.15 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 172.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.1 t80 64.89 8.93 4.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.666 0.746 . . . . 0.0 109.004 -173.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 37.63 60.95 1.07 Allowed 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.475 -171.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.694 HG12 HD22 ' A' ' 51' ' ' ASN . 12.1 tt -82.02 26.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 -178.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.962 HD23 ' HA ' ' A' ' 44' ' ' TYR . 2.2 mm? -77.64 3.02 14.88 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.183 -173.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -71.14 -18.35 62.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.256 0.55 . . . . 0.0 109.82 176.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.694 HD22 HG12 ' A' ' 48' ' ' ILE . 1.1 p-10 -139.3 74.67 34.89 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.2 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -85.87 8.61 4.44 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.631 2.221 . . . . 0.0 110.757 170.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.67 120.82 61.24 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.476 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -96.91 -0.22 1.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.101 2.534 . . . . 0.0 114.158 -176.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 t -75.85 -25.5 56.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.87 0.367 . . . . 0.0 111.151 -173.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.674 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -88.21 2.69 51.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.085 179.216 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.557 ' CE1' HD23 ' A' ' 105' ' ' LEU . 15.9 m-85 -106.31 130.53 54.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.181 -175.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.599 HG21 ' O ' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -113.08 165.57 7.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 168.017 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.538 HD13 ' HB3' ' A' ' 101' ' ' PHE . 17.6 tp -118.56 138.38 52.59 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.586 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.4 mm? -98.72 126.55 44.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.792 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.676 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.6 pt-20 -88.81 84.35 6.67 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.609 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 12.7 tt0 -85.77 123.37 31.08 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 119.477 -0.889 . . . . 0.0 108.798 175.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.585 HG23 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.01 108.82 25.9 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.738 0.78 . . . . 0.0 110.327 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.558 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 78.9 t -77.34 143.76 12.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.558 -173.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.904 ' HZ1' ' HB3' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -133.05 85.25 2.2 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 169.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.551 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 5.2 t70 -82.08 -177.64 6.7 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.626 -173.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.462 ' O ' HG21 ' A' ' 67' ' ' THR . 8.9 t -86.59 76.26 9.58 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 122.355 1.074 . . . . 0.0 111.466 -173.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.7 m -68.16 -38.2 81.85 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -73.2 -174.88 1.69 Allowed 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.49 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 40.2 mmtm -142.23 151.43 42.09 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.432 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 24.4 ttmm 72.38 -49.89 0.7 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 124.009 0.818 . . . . 0.0 110.667 -173.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -105.65 153.1 22.29 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.625 176.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 10.0 m 68.1 97.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.573 0.545 . . . . 0.0 111.238 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 25.7 p -90.07 164.6 27.41 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.959 176.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 31.3 Cg_exo -58.24 124.79 16.7 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.972 1.781 . . . . 0.0 111.481 177.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.496 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 12.5 mmmm -137.98 145.51 42.03 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.592 -174.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.7 p -123.69 127.85 48.79 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.867 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -109.62 100.67 9.68 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.552 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.8 tt0 -95.05 131.27 41.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -134.35 129.89 36.13 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.576 HG13 HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -85.86 136.47 22.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.269 -173.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 22.3 mt -93.63 151.8 19.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.501 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.452 ' HB2' ' HG2' ' A' ' 86' ' ' GLU . 7.1 mp -80.2 167.03 20.83 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 163.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -54.63 -31.86 57.99 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.636 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 2.3 pt20 -122.13 39.84 3.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 8.1 mm-40 -76.92 -7.51 55.69 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.262 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.665 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 12.7 t 70.21 130.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 0.0 111.333 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.569 ' H ' ' HA ' ' A' ' 30' ' ' THR . 93.8 t -78.58 -46.89 24.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 CA-C-O 121.344 0.592 . . . . 0.0 109.768 178.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -72.55 -41.37 65.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.557 -175.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.699 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 8.2 mm-40 -63.65 -43.61 96.25 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.345 175.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.88 -49.3 77.18 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.866 0.365 . . . . 0.0 110.436 175.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -57.64 -35.39 70.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.291 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -78.42 -5.96 53.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.012 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 73.1 mmtt -95.5 -12.64 25.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.227 0.536 . . . . 0.0 110.368 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.407 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 27.2 m0 -57.28 140.21 50.62 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -169.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.585 ' H ' HG23 ' A' ' 63' ' ' VAL . 3.7 mppt? -102.23 38.9 1.58 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.766 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 155.12 -175.5 33.09 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.93 -177.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.558 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.43 108.76 21.31 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.985 0.392 . . . . 0.0 110.168 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.609 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -113.46 -150.32 10.54 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.425 -177.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.467 ' HE2' ' HB2' ' A' ' 100' ' ' LYS . 27.8 mtmm -150.25 139.29 21.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.631 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 97.9 m-85 -83.23 146.49 28.55 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.753 -0.779 . . . . 0.0 108.971 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.586 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 80.1 mt -136.23 127.23 42.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 O-C-N 122.182 -0.324 . . . . 0.0 111.376 -172.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.501 ' HG ' HD12 ' A' ' 35' ' ' ILE . 4.7 mp -79.28 109.8 13.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.16 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.599 ' O ' HG21 ' A' ' 58' ' ' VAL . 33.6 ttpt -139.67 136.93 34.78 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 176.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.584 HD21 ' O ' ' A' ' 56' ' ' ASP . 18.5 mt -69.17 142.64 54.26 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.461 0.648 . . . . 0.0 112.507 -171.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.4 ptmm? -69.75 -30.98 68.7 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.427 -1.261 . . . . 0.0 110.084 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.406 ' OE1' ' HG3' ' A' ' 106' ' ' LYS . 5.0 mm-40 -68.16 -19.05 64.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.132 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -109.93 -10.6 14.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.539 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.576 HG13 HG13 ' A' ' 81' ' ' VAL . 0.9 OUTLIER -92.56 -33.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.125 -179.413 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 10.9 mm-40 -56.66 85.4 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.319 0 O-C-N 123.836 0.71 . . . . 0.0 112.831 -172.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.98 1.52 6.57 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.056 -0.975 . . . . 0.0 108.559 170.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.1 m -88.48 78.32 7.89 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.145 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.55 ' HB2' ' OE1' ' A' ' 114' ' ' GLU . 43.3 mtm180 -85.56 -59.74 2.23 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 173.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.55 ' OE1' ' HB2' ' A' ' 113' ' ' ARG . 4.1 mp0 -68.74 -48.61 63.33 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.266 -1.334 . . . . 0.0 109.797 175.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -70.86 151.48 44.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.828 174.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.512 ' HA ' ' HE3' ' A' ' 116' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.011 -176.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.626 0.251 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 p -167.54 174.92 7.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.49 -174.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -72.88 -33.6 66.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 176.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -84.49 137.45 33.34 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 170.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 36.8 tt0 -102.81 139.17 38.74 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m -104.2 148.29 26.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.664 0.745 . . . . 0.0 111.755 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.846 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 16.5 p90 -115.78 149.84 37.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.598 -1.183 . . . . 0.0 107.896 176.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -82.73 119.8 24.78 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.563 -173.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.579 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.7 t -108.72 130.98 60.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.652 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.433 ' HG2' HG23 ' A' ' 22' ' ' VAL . 45.9 mt-30 -104.15 109.01 20.65 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 164.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.627 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.5 p -129.23 121.65 54.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.066 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.607 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 91.1 m-70 -71.45 150.6 44.76 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.039 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -96.79 -164.95 1.2 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.074 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.4 p -118.13 10.66 7.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 122.11 0.957 . . . . 0.0 108.79 173.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -108.06 153.41 41.78 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.631 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -85.68 -175.38 1.88 Allowed 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.677 2.251 . . . . 0.0 112.59 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.465 ' HB2' ' HH ' ' A' ' 46' ' ' TYR . 32.0 mm-40 72.93 -56.67 0.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.812 0.845 . . . . 0.0 110.542 -178.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -123.52 87.4 52.12 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 172.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -83.12 9.13 4.22 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 123.112 2.541 . . . . 0.0 112.841 -174.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 12' ' ' HIS . 64.6 tp -143.47 124.98 14.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.738 0.304 . . . . 0.0 110.823 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.484 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.5 m -94.81 124.89 39.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.528 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.433 HG23 ' HG2' ' A' ' 10' ' ' GLN . 46.8 t -102.86 112.92 38.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 171.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.579 HG13 ' HB ' ' A' ' 9' ' ' VAL . 3.1 pt -128.3 168.25 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.132 0.492 . . . . 0.0 111.626 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -117.85 96.98 5.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.67 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -100.69 157.65 33.33 Favored Pre-proline 0 CA--C 1.499 -0.998 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.741 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.9 Cg_exo -63.7 140.48 74.67 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 121.587 1.525 . . . . 0.0 111.436 -174.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.846 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 59.4 mtp180 -62.88 -0.74 0.72 Allowed 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 121.296 0.569 . . . . 0.0 110.421 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.472 ' H ' ' C ' ' A' ' 26' ' ' PRO . 32.9 m -114.57 -7.16 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.763 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.741 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -59.48 135.07 57.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.124 0.487 . . . . 0.0 110.707 177.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.45 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 9.7 p -99.62 -168.29 1.58 Allowed 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.45 ' HA ' ' CG1' ' A' ' 88' ' ' VAL . . . -60.54 -50.28 74.19 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.922 -176.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.612 ' HG2' ' HB2' ' A' ' 84' ' ' ASP . 0.1 OUTLIER -59.03 -30.97 68.42 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.736 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -73.75 -52.89 11.68 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.931 0.872 . . . . 0.0 109.824 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.401 HG12 HG12 ' A' ' 88' ' ' VAL . 6.8 p -66.11 -28.14 42.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.679 -1.6 . . . . 0.0 110.3 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.49 HD11 ' HG ' ' A' ' 103' ' ' LEU . 2.3 mm -55.87 -56.21 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.389 171.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.579 ' HG2' ' HG3' ' A' ' 54' ' ' PRO . 40.9 mt-30 -64.33 -32.22 73.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.183 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.67 HE22 ' HA ' ' A' ' 25' ' ' ALA . 7.6 tt0 -61.27 -39.02 88.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.049 179.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.3 m -67.88 -38.81 83.49 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.977 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -55.56 -38.6 69.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.639 174.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.64 -45.62 89.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.133 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -70.8 -35.65 72.63 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.787 0.327 . . . . 0.0 110.942 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.48 12.86 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.683 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.69 ' HZ2' ' HB3' ' A' ' 43' ' ' LYS . 7.8 ttpm? -69.88 120.88 16.29 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.789 ' HA ' HD22 ' A' ' 49' ' ' LEU . 89.0 m-85 62.77 -126.66 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 O-C-N 123.843 0.714 . . . . 0.0 109.297 -169.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.7 m 64.83 -87.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.017 0.527 . . . . 0.0 111.517 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.465 ' HH ' ' HB2' ' A' ' 17' ' ' GLU . 90.8 m-85 -112.05 19.56 17.71 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.615 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 17.6 p 51.46 78.58 0.11 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.463 -176.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.551 ' O ' HG21 ' A' ' 48' ' ' ILE . 4.2 mp -94.75 14.45 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.348 174.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 44' ' ' TYR . 1.4 mm? -78.82 7.25 7.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.231 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t -71.08 -29.59 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.102 177.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -139.9 79.31 23.23 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.081 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -81.52 0.23 10.04 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.062 2.508 . . . . 0.0 112.096 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -98.18 121.08 58.24 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.607 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.579 ' HG3' ' HG2' ' A' ' 36' ' ' GLN . 86.3 Cg_endo -82.04 -5.93 12.15 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.049 2.499 . . . . 0.0 113.338 -171.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.0 m -65.31 -12.71 54.6 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.053 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -98.68 8.74 44.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.282 0.563 . . . . 0.0 110.35 -178.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 42.1 m-85 -118.02 139.01 51.81 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.168 -174.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.57 HG11 ' HE2' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -104.99 178.9 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 162.062 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.561 ' HB3' HD13 ' A' ' 82' ' ' LEU . 21.0 tp -134.83 145.71 48.58 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.656 ' O ' ' HA ' ' A' ' 101' ' ' PHE . 2.6 mm? -102.05 126.92 49.11 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.618 ' HG2' ' HB3' ' A' ' 80' ' ' ARG . 11.2 pt-20 -92.32 83.75 5.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.491 1.139 . . . . 0.0 108.202 169.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.617 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -86.7 125.42 33.87 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.501 -0.75 . . . . 0.0 110.082 176.478 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.577 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.9 OUTLIER -117.54 111.33 34.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.28 0.562 . . . . 0.0 110.364 175.176 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.551 HG21 ' OE2' ' A' ' 62' ' ' GLU . 88.9 t -72.29 104.31 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.577 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -85.05 84.5 7.69 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 170.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.415 ' CG ' ' HZ3' ' A' ' 71' ' ' LYS . 24.4 t70 -73.06 151.4 41.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.289 -172.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.446 HG23 ' HB ' ' A' ' 73' ' ' THR . 0.2 OUTLIER -71.02 -14.98 62.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.407 -175.113 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.5 m 60.07 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.594 0.758 . . . . 0.0 112.673 172.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -35.53 80.36 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.433 0.635 . . . . 0.0 110.153 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -104.15 86.22 2.52 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.068 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 71' ' ' LYS . 8.2 mmpt? -74.01 -19.6 60.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.026 0.441 . . . . 0.0 110.705 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.4 t -79.57 -4.27 50.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.252 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.446 ' HB ' HG23 ' A' ' 67' ' ' THR . 23.0 m -112.73 125.62 54.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.548 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.436 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 36.2 p -50.43 136.5 23.8 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.851 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 13.8 Cg_exo -68.09 165.15 29.34 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 123.03 2.487 . . . . 0.0 111.407 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmm -116.29 95.64 5.17 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.465 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 15.0 m -83.61 106.6 15.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.455 0.645 . . . . 0.0 110.613 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -89.85 99.87 12.8 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.483 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.587 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 7.0 tt0 -94.36 131.57 39.87 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.618 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 50.2 ttt180 -127.44 149.73 49.96 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.749 HG13 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -111.86 135.07 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 118.959 0.799 . . . . 0.0 111.498 -175.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' A' ' 59' ' ' LEU . 35.2 mt -89.99 -161.58 0.8 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.802 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.448 ' HB3' ' OE2' ' A' ' 86' ' ' GLU . 37.0 tp -131.93 -51.68 0.97 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.839 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.612 ' HB2' ' HG2' ' A' ' 32' ' ' GLN . 17.7 p-10 177.34 -38.36 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.41 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.424 ' HG3' ' CG ' ' A' ' 84' ' ' ASP . 40.9 mt-30 -118.3 19.22 13.52 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -174.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.0 mp0 -62.69 -6.63 3.76 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -177.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 90.4 m 67.84 96.26 0.06 Allowed 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.531 0.52 . . . . 0.0 110.018 -176.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 31' ' ' ALA . 17.9 m -68.92 -27.21 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.282 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -71.42 -39.25 71.19 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.137 -1.025 . . . . 0.0 108.991 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.646 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 39.2 mm-40 -68.05 -43.33 78.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.576 176.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.7 79.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.455 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.9 -30.89 69.33 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.089 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.3 t -77.67 -19.67 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.514 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.646 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 31.5 mmtp -75.23 -23.86 57.61 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.956 0.407 . . . . 0.0 110.367 177.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.3 m0 -58.92 158.34 8.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -171.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -131.03 23.13 4.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 113.815 -1.539 . . . . 0.0 109.376 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -169.04 174.29 43.54 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -93.77 98.33 11.02 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 117.458 0.629 . . . . 0.0 110.99 -177.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.64 ' O ' ' HG3' ' A' ' 100' ' ' LYS . . . -106.53 -152.54 19.46 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.784 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.64 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 10.1 mtmm -156.39 149.63 24.35 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.656 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 94.4 m-85 -82.9 151.02 26.14 Favored 'General case' 0 C--N 1.312 -1.03 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.163 169.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.514 HG13 ' HB2' ' A' ' 12' ' ' HIS . 4.4 mp -130.58 125.56 59.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 121.959 -0.463 . . . . 0.0 110.62 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.49 ' HG ' HD11 ' A' ' 35' ' ' ILE . 1.9 mp -71.05 131.2 43.28 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -154.99 170.15 22.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.3 mp -96.15 145.18 25.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.493 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.57 ' HE2' HG11 ' A' ' 58' ' ' VAL . 15.7 ptpt -82.3 -12.52 57.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.935 0.874 . . . . 0.0 110.043 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -89.95 -2.08 58.09 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.062 170.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -108.15 -41.19 4.98 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.749 HG12 HG13 ' A' ' 81' ' ' VAL . 55.1 t -91.94 105.97 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.574 170.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.678 ' HG3' ' HB3' ' A' ' 112' ' ' SER . 2.7 pt20 -145.4 -176.91 5.3 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.584 -174.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -81.07 66.82 6.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.678 ' HB3' ' HG3' ' A' ' 110' ' ' GLN . 83.8 p -105.26 -168.53 1.48 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.492 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.544 ' CZ ' ' HA ' ' A' ' 113' ' ' ARG . 0.6 OUTLIER -99.09 71.14 1.82 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.587 ' HG2' ' H ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -110.25 -31.48 7.3 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.243 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 63.15 26.18 15.18 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.42 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.587 ' H ' ' HG2' ' A' ' 114' ' ' GLU . 57.6 tttm . . . . . 0 C--O 1.235 0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.253 178.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.796 0.331 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 m -88.82 82.5 6.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -131.85 4.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.283 -173.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -120.1 124.67 46.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.116 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.794 ' HG2' ' HD3' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -102.53 121.33 42.14 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.27 177.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 p -99.89 140.79 33.6 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.626 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.836 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.0 p90 -105.91 154.73 20.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -84.9 128.67 34.72 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.162 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.427 ' CG1' HG23 ' A' ' 11' ' ' VAL . 0.8 OUTLIER -122.17 128.89 75.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.072 175.005 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' A' ' 20' ' ' LEU . 47.1 mt-30 -100.65 106.01 17.43 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 165.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.649 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -115.69 112.49 39.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.301 -169.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 21.5 m-70 -62.11 139.88 58.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.156 0.503 . . . . 0.0 112.169 -173.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.414 ' OD1' ' HB2' ' A' ' 46' ' ' TYR . 18.1 t70 -86.67 169.73 12.43 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 165.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.459 ' HB ' ' CD2' ' A' ' 46' ' ' TYR . 16.9 t -81.89 -23.89 9.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.549 -178.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.721 ' HB3' ' HD1' ' A' ' 46' ' ' TYR . 79.0 p -92.44 142.01 25.44 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.821 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.4 -9.55 26.3 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.453 2.102 . . . . 0.0 111.764 173.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -60.44 -33.59 72.76 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 174.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -123.88 92.98 47.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.419 170.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -62.42 -18.26 62.09 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.156 2.571 . . . . 0.0 112.737 -175.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.537 HD12 ' HD3' ' A' ' 100' ' ' LYS . 5.7 mt -163.88 125.24 2.31 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.376 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 18.8 m -93.52 108.56 20.24 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.424 175.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.5 p -92.51 119.61 40.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.438 0.637 . . . . 0.0 110.569 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 24.5 pt -128.78 144.13 39.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.345 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -98.32 95.39 7.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 170.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.63 165.17 14.21 Favored Pre-proline 0 CA--C 1.506 -0.744 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.701 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.65 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 6.1 Cg_exo -68.65 139.89 45.57 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 122.015 1.81 . . . . 0.0 112.129 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.836 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.8 mtp180 -61.76 -8.66 5.03 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.1 m -99.09 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.604 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.65 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 15.9 m -60.87 120.43 10.15 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.433 0.635 . . . . 0.0 111.5 174.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.511 ' CB ' ' HA ' ' A' ' 87' ' ' CYS . 1.8 t -100.0 179.07 4.61 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.35 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.602 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.2 -52.44 20.88 Favored 'General case' 0 C--O 1.216 -0.684 0 O-C-N 123.592 0.557 . . . . 0.0 111.697 -170.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.734 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -63.86 -31.88 73.21 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -177.323 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.78 -50.34 21.05 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.8 0.81 . . . . 0.0 109.678 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.619 HG12 HD23 ' A' ' 59' ' ' LEU . 1.4 p -66.6 -27.9 41.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.442 179.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 31' ' ' ALA . 5.6 mm -56.23 -57.55 8.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.078 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.534 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 41.8 tt0 -67.26 -35.1 78.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -178.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -59.47 -43.6 93.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 120.892 0.377 . . . . 0.0 110.657 175.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.3 m -71.16 -31.63 67.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.046 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.534 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 4.8 mp -55.91 -39.61 71.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.198 0.523 . . . . 0.0 110.384 171.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.3 m -72.61 -29.7 63.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.012 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -75.08 -41.1 59.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.401 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.09 44.99 0.8 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.375 0.607 . . . . 0.0 110.509 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.744 ' HZ2' ' HB3' ' A' ' 43' ' ' LYS . 6.9 ttpm? -61.94 -30.57 71.0 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.14 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -148.99 0.85 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 m -52.8 -81.43 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.767 0.318 . . . . 0.0 111.725 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.721 ' HD1' ' HB3' ' A' ' 15' ' ' SER . 70.2 t80 -90.88 19.45 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.9 p 48.73 55.32 9.3 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.65 -171.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mt -75.83 71.07 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 122.717 1.246 . . . . 0.0 108.44 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 43' ' ' LYS . 14.4 mt -124.41 -28.68 3.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.164 -1.835 . . . . 0.0 108.42 -176.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -76.79 123.08 25.68 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 163.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 65.66 68.69 0.66 Allowed Pre-proline 0 N--CA 1.467 0.419 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -168.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -85.45 9.25 4.18 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.084 2.523 . . . . 0.0 111.213 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -97.83 124.57 47.52 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.928 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.734 ' HB2' HE22 ' A' ' 32' ' ' GLN . 66.8 Cg_endo -74.71 -10.53 21.75 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.793 2.329 . . . . 0.0 113.19 -173.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.553 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 70.1 m -85.69 8.77 18.42 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -175.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 79.1 m-20 -109.42 -2.15 17.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.305 0.574 . . . . 0.0 109.701 169.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 33.4 m-85 -108.26 154.97 21.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.753 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.621 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.25 155.6 37.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 169.439 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.621 HD22 ' HB3' ' A' ' 101' ' ' PHE . 22.8 tp -103.1 146.75 27.91 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.991 0.425 . . . . 0.0 110.009 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.645 HD12 HG12 ' A' ' 81' ' ' VAL . 2.1 mm? -106.81 125.45 51.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.881 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.643 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.6 pt-20 -87.76 82.67 7.29 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.3 1.048 . . . . 0.0 108.271 170.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.539 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -87.4 123.55 32.47 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 121.555 -0.716 . . . . 0.0 109.7 176.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.691 HG23 ' H ' ' A' ' 96' ' ' LYS . 0.3 OUTLIER -119.39 118.11 56.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.107 178.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.553 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 63.3 t -79.93 109.79 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.396 177.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -91.19 92.55 8.71 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 172.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -71.06 152.71 43.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.501 -174.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.475 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.0 t -119.79 149.05 42.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.09 -175.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 m -76.48 -5.82 49.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.43 0.633 . . . . 0.0 110.417 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -78.26 0.75 24.05 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.896 -177.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 67' ' ' THR . 37.1 mtmm -52.65 98.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -170.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -148.28 -61.59 0.25 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 m -111.24 -27.42 8.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.741 -1.118 . . . . 0.0 108.464 170.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.4 m -84.02 121.58 27.59 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.394 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 21.5 p -90.61 159.35 41.21 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.93 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.38 147.53 56.36 Favored 'Trans proline' 0 CA--C 1.507 -0.855 0 C-N-CA 122.907 2.405 . . . . 0.0 112.107 176.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.644 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -113.43 100.32 8.44 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 113.852 -1.522 . . . . 0.0 111.516 -164.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 13.4 p -72.79 129.34 37.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.75 176.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.8 m -111.21 107.25 16.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.499 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 7.0 tt0 -93.8 131.03 39.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.88 0.371 . . . . 0.0 110.18 -172.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.47 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 55.2 ttt180 -128.01 151.62 48.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.804 HG13 HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -106.18 144.28 15.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.99 -178.584 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.615 HD23 ' HB3' ' A' ' 61' ' ' GLU . 22.4 mt -101.71 150.88 22.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.566 -175.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -88.72 -173.49 4.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.151 170.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.23 -50.69 70.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 111.238 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -116.14 40.12 2.92 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.645 -177.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.426 ' HG3' ' NZ ' ' A' ' 94' ' ' LYS . 30.2 tp10 -76.1 -11.37 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 175.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.511 ' HA ' ' CB ' ' A' ' 30' ' ' THR . 67.1 m 65.0 126.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 114.6 -1.182 . . . . 0.0 112.623 172.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.476 HG23 HG12 ' A' ' 34' ' ' VAL . 64.6 t -76.03 -42.26 38.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.559 -174.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -72.26 -38.61 68.8 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.62 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -62.06 -42.1 98.84 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.87 174.822 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.523 ' HA ' ' CE ' ' A' ' 94' ' ' LYS . . . -60.5 -43.95 96.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.638 176.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -61.17 -31.75 71.49 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.546 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.1 t -77.12 -13.84 59.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.111 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.62 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 64.4 mttt -85.1 -18.27 34.78 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.493 0.663 . . . . 0.0 110.285 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.454 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.9 m0 -62.32 145.79 52.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.355 -170.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.691 ' H ' HG23 ' A' ' 63' ' ' VAL . 20.5 mttp -115.41 23.8 12.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.754 -1.566 . . . . 0.0 108.169 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 175.89 -171.44 44.49 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-N 114.072 -1.422 . . . . 0.0 110.227 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.11 108.56 20.01 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 117.304 0.552 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.551 ' HA2' ' HA ' ' A' ' 63' ' ' VAL . . . -114.85 -151.02 10.05 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.829 -177.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.537 ' HD3' HD12 ' A' ' 20' ' ' LEU . 1.1 mtmp? -150.46 149.56 30.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.649 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -91.2 124.08 35.14 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.874 168.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.0 mp -111.5 129.44 66.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.304 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 35' ' ' ILE . 3.8 mp -77.98 131.08 37.24 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.892 175.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.59 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.0 ttmm -145.87 -177.1 5.41 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.59 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 4.7 mp -106.57 135.71 47.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.92 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.621 ' CA ' HG23 ' A' ' 58' ' ' VAL . 16.5 ptmt -69.92 -31.88 69.88 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.344 -177.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.565 ' HA ' ' HG2' ' A' ' 110' ' ' GLN . 12.0 pt-20 -74.7 -15.77 60.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -95.49 -23.9 16.9 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.804 HG13 HG13 ' A' ' 81' ' ' VAL . 55.8 t -86.31 8.72 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.519 175.142 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.577 ' HB3' ' O ' ' A' ' 113' ' ' ARG . 28.2 mm-40 -75.95 51.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 171.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.88 -10.24 59.26 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.453 -176.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 32.6 m -128.0 -35.5 2.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.93 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.577 ' O ' ' HB3' ' A' ' 110' ' ' GLN . 36.0 ttt180 -103.2 109.11 20.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.091 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -98.52 -72.71 0.64 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.455 ' CG ' ' H ' ' A' ' 116' ' ' LYS . 8.0 t70 -175.73 -159.51 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.455 ' H ' ' CG ' ' A' ' 115' ' ' ASP . 38.4 pttt . . . . . 0 C--N 1.324 -0.532 0 CA-C-O 120.578 0.228 . . . . 0.0 110.979 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 121.126 0.489 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.5 t -179.54 77.78 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -93.02 -11.7 32.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.008 -169.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.459 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 1.9 pm0 -84.34 148.41 26.66 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.052 174.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -121.7 117.28 26.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.717 0.77 . . . . 0.0 111.953 -174.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.607 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 7.9 p -123.05 139.75 53.74 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.4 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.751 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 18.0 p90 -107.26 148.3 29.13 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -79.59 131.7 36.08 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.758 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.421 ' CG1' HG13 ' A' ' 11' ' ' VAL . 1.9 t -122.81 142.64 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.571 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -111.56 107.07 16.11 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 167.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -122.63 139.65 48.86 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -175.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.674 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 92.5 m-70 -89.74 121.05 31.54 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.951 177.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.41 172.78 6.63 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 172.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.46 39.19 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 111.372 -170.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.708 ' HA ' ' HB2' ' A' ' 46' ' ' TYR . 36.7 m -115.15 151.8 46.08 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.449 . . . . 0.0 111.159 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.492 ' HD3' ' CD1' ' A' ' 46' ' ' TYR . 89.5 Cg_endo -94.43 -11.85 1.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.301 2.667 . . . . 0.0 112.892 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.53 -24.79 59.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.001 0.429 . . . . 0.0 110.428 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -149.81 95.47 3.68 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.77 -44.72 38.34 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.607 2.204 . . . . 0.0 111.737 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.8 tp -107.53 100.27 9.7 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.26 108.76 7.24 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.489 -179.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.25 123.07 47.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 121.981 -0.449 . . . . 0.0 109.925 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.3 pt -130.36 175.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.147 0.499 . . . . 0.0 110.776 -178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.607 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 44.0 tttp -132.06 96.98 4.03 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 171.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.91 158.21 32.23 Favored Pre-proline 0 CA--C 1.5 -0.948 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.527 -176.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.724 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 8.1 Cg_exo -61.59 141.76 92.4 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.93 1.753 . . . . 0.0 111.625 -174.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.751 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.6 mtp-105 -61.79 -2.36 0.82 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.872 0.844 . . . . 0.0 110.235 -179.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.527 ' H ' ' C ' ' A' ' 26' ' ' PRO . 3.4 p -107.67 -21.95 5.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.413 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.724 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 98.8 p -56.18 127.76 32.28 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 120.93 0.395 . . . . 0.0 110.353 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.494 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 7.7 p -95.27 -166.51 1.47 Allowed 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.441 ' HA ' HG11 ' A' ' 88' ' ' VAL . . . -59.26 -50.05 75.5 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.042 -177.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' NE2' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -60.72 -31.83 71.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 -178.067 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -73.29 -53.16 11.52 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 122.128 0.966 . . . . 0.0 109.797 -176.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.506 HG12 HG12 ' A' ' 88' ' ' VAL . 5.4 p -65.96 -27.96 42.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 113.771 -1.558 . . . . 0.0 110.29 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.516 HD11 ' HB3' ' A' ' 57' ' ' TYR . 4.3 mm -56.42 -56.52 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.134 170.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.457 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 34.6 tt0 -69.63 -33.4 72.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.384 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -62.03 -36.11 80.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.012 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.2 m -69.33 -37.3 77.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.899 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 7.4 mp -53.65 -44.21 69.41 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.157 0.503 . . . . 0.0 110.101 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 48.9 t -63.39 -36.19 82.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.08 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.34 -12.01 58.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.755 0.312 . . . . 0.0 111.56 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.32 17.07 14.76 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 40' ' ' CYS . 0.9 OUTLIER -73.46 11.64 0.75 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -178.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.595 ' HA ' ' HA ' ' A' ' 47' ' ' SER . 27.7 p90 -167.38 4.94 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.544 167.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 t -62.0 -68.79 0.29 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.756 0.312 . . . . 0.0 110.473 -175.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.708 ' HB2' ' HA ' ' A' ' 15' ' ' SER . 32.5 t80 -90.95 18.79 6.23 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 167.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.595 ' HA ' ' HA ' ' A' ' 44' ' ' TYR . 12.0 m 58.03 50.49 10.07 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.38 -172.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.433 HD12 ' HD2' ' A' ' 46' ' ' TYR . 39.9 mm -81.51 68.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.534 0.683 . . . . 0.0 109.381 175.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 44' ' ' TYR . 5.7 mp -104.32 -6.5 20.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.481 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.9 m -77.95 -24.48 48.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.612 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -122.47 101.48 40.43 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.358 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -101.47 14.14 0.38 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.406 2.737 . . . . 0.0 113.034 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.16 116.14 16.58 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 122.143 0.973 . . . . 0.0 111.34 -177.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.423 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 72.7 Cg_endo -80.06 8.13 4.26 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 123.024 2.483 . . . . 0.0 112.437 -175.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 p -73.17 -3.62 27.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.784 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.596 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 m-20 -107.81 -3.38 19.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.36 176.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.516 ' HB3' HD11 ' A' ' 35' ' ' ILE . 35.4 m-85 -103.56 145.82 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.829 -171.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.556 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -135.33 151.98 31.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.608 165.166 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.815 HD22 ' HB3' ' A' ' 101' ' ' PHE . 32.5 tp -104.51 147.17 27.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.041 0.448 . . . . 0.0 111.274 -174.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.546 HD12 HG12 ' A' ' 81' ' ' VAL . 1.7 mm? -102.84 124.9 49.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.732 176.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.658 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.5 pt-20 -88.82 87.31 7.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.232 1.015 . . . . 0.0 108.569 170.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.651 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 1.3 tt0 -85.86 124.47 32.37 Favored 'General case' 0 N--CA 1.426 -1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 109.685 175.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.553 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -118.18 113.8 43.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-O 121.188 0.518 . . . . 0.0 110.159 175.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.552 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t -77.78 110.1 13.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.593 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 8.9 ptpp? -98.91 90.84 4.79 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 171.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -104.6 171.27 7.42 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.731 -175.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.8 t -144.67 117.73 8.87 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.891 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.7 m -88.57 -7.6 56.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.572 0.701 . . . . 0.0 110.063 -175.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -101.75 -59.01 1.77 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 -178.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -82.17 82.65 7.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.206 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 71' ' ' LYS . 1.6 mmmp? -80.99 17.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -174.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.4 t -65.46 -18.94 65.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -134.36 151.22 51.09 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.478 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.5 p -82.0 163.53 52.81 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.931 175.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.99 126.23 21.54 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 121.86 1.707 . . . . 0.0 110.925 174.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.648 ' HB3' ' HZ1' ' A' ' 76' ' ' LYS . 10.3 mtpm? -108.92 99.84 9.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.628 -171.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.2 p -73.77 103.34 4.29 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.653 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.7 m -86.51 101.0 12.78 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.525 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.588 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 33.2 tt0 -93.91 129.86 40.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.86 -175.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.467 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 38.5 ttt-85 -125.84 147.38 49.46 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.945 HG13 HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -101.65 143.24 14.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.362 178.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.539 HD11 ' HB3' ' A' ' 59' ' ' LEU . 45.3 mt -98.57 162.96 12.86 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.609 -176.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.541 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 58.6 mt -84.65 174.68 9.76 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 166.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 11.3 m-20 -55.05 -44.24 74.55 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.911 0.386 . . . . 0.0 110.546 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -121.35 53.36 1.17 Allowed 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.629 0.252 . . . . 0.0 111.374 176.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.541 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.2 OUTLIER -75.04 -4.29 37.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.559 174.283 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.494 ' HA ' ' HB ' ' A' ' 30' ' ' THR . 47.1 m 64.39 105.72 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.179 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.541 HG12 HD21 ' A' ' 59' ' ' LEU . 17.9 m -74.39 -27.37 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 O-C-N 122.311 -0.243 . . . . 0.0 111.585 -178.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -70.82 -38.58 73.27 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.435 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -63.65 -48.28 77.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.074 175.604 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.52 -50.51 67.69 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.401 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.502 ' OE1' ' HE2' ' A' ' 7' ' ' PHE . 20.8 tt0 -63.63 -37.18 86.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.707 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.4 p -75.4 -10.36 59.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.532 0.682 . . . . 0.0 110.263 176.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -101.94 -0.43 33.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.646 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.442 ' C ' ' HD3' ' A' ' 96' ' ' LYS . 40.3 m0 -75.62 158.42 32.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 122.131 0.967 . . . . 0.0 112.78 175.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.486 ' H ' HG22 ' A' ' 63' ' ' VAL . 3.8 mppt? -126.94 29.87 5.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 113.466 -1.697 . . . . 0.0 109.228 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -175.36 -153.01 9.81 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.887 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -121.22 104.39 9.7 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.825 0.345 . . . . 0.0 110.248 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.651 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -114.56 -154.46 10.9 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.075 -1.059 . . . . 0.0 113.112 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.864 ' HZ1' ' HB2' ' A' ' 100' ' ' LYS . 4.8 mtmp? -151.77 137.3 17.75 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.352 0.661 . . . . 0.0 109.76 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.815 ' HB3' HD22 ' A' ' 59' ' ' LEU . 92.3 m-85 -81.21 119.56 23.77 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.878 174.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 58.2 mt -110.26 120.16 60.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 O-C-N 121.993 -0.442 . . . . 0.0 111.122 -172.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.646 HD13 HD11 ' A' ' 59' ' ' LEU . 1.6 mp -71.08 128.55 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.394 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 18.3 ttmm -144.71 -177.76 5.67 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 175.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.502 ' HB3' ' HG3' ' A' ' 107' ' ' GLU . 38.7 mt -110.05 149.61 29.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.641 0.734 . . . . 0.0 111.852 -179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 19.0 ptmt -87.31 -12.31 46.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.136 -179.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.502 ' HG3' ' HB3' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -79.79 -5.89 56.24 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.315 169.5 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.46 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 47.8 mt-30 -107.54 -51.07 2.96 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.945 HG13 HG13 ' A' ' 81' ' ' VAL . 91.6 t -84.01 90.1 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-N 114.116 -1.402 . . . . 0.0 109.969 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.488 ' C ' ' H ' ' A' ' 112' ' ' SER . 3.8 pt20 -131.16 44.58 2.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.544 -176.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 68.52 -11.66 0.39 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.126 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.488 ' H ' ' C ' ' A' ' 110' ' ' GLN . 92.2 p 57.71 174.86 0.05 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.593 1.157 . . . . 0.0 112.55 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.73 -24.15 11.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -71.16 -30.31 66.29 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.127 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.65 114.6 3.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.971 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.546 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.475 0.781 0 CA-C-O 120.712 0.291 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 27' ' ' ARG . 66.6 m -139.59 5.37 2.21 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.133 0.492 . . . . 0.0 111.495 -179.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -86.07 -10.56 54.74 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.632 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -102.09 5.9 40.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.486 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -129.92 147.38 51.67 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.096 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.556 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 9.8 p -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.073 0.463 . . . . 0.0 109.972 176.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.886 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.6 p90 -104.75 154.03 20.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -83.95 137.95 33.38 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.65 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.524 HG21 ' CE2' ' A' ' 7' ' ' PHE . 2.1 t -128.23 139.52 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.828 0.347 . . . . 0.0 110.265 176.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -107.58 106.29 16.57 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 165.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.692 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -116.45 134.38 60.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -89.35 146.16 24.87 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.96 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' A' ' 14' ' ' VAL . 9.1 t70 -97.64 -167.3 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.417 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 12.8 t -108.01 -15.06 9.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 176.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.404 ' HB3' ' CE2' ' A' ' 46' ' ' TYR . 1.3 m -96.63 151.97 38.27 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.108 -175.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.417 ' C ' ' H ' ' A' ' 18' ' ' GLN . 8.8 Cg_exo -72.57 -174.98 1.63 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.989 2.459 . . . . 0.0 111.772 175.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.413 ' HB3' ' O ' ' A' ' 16' ' ' PRO . 11.4 tp10 72.77 -42.72 0.54 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.237 0.615 . . . . 0.0 110.559 -176.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.417 ' H ' ' C ' ' A' ' 16' ' ' PRO . 8.6 pt20 -122.92 71.57 42.22 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.391 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.412 ' HD3' ' C ' ' A' ' 17' ' ' GLU . 22.8 Cg_exo -64.57 -39.33 28.16 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.307 2.005 . . . . 0.0 110.708 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -120.49 114.14 21.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.022 174.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -92.14 109.94 21.31 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.336 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.9 p -91.82 112.74 26.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.782 0.801 . . . . 0.0 110.553 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.8 pt -121.17 171.19 10.2 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.741 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.556 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 41.5 tttp -129.25 96.12 4.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 172.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.22 161.57 22.5 Favored Pre-proline 0 CA--C 1.507 -0.706 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.324 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.961 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.9 Cg_exo -64.91 143.35 79.15 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 121.779 1.653 . . . . 0.0 111.817 -172.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.886 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 58.5 mtp85 -63.23 -1.68 1.13 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.317 0.579 . . . . 0.0 110.48 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.473 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.6 m -118.69 -0.88 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.524 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.961 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 84.4 p -59.89 139.09 57.61 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.132 0.491 . . . . 0.0 110.846 175.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.651 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 1.8 t -107.35 179.22 4.31 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.498 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.99 -48.97 61.22 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 123.206 0.316 . . . . 0.0 111.495 -175.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.615 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -59.65 -32.54 70.55 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.539 0.209 . . . . 0.0 110.911 -179.177 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.66 -54.18 9.75 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.059 0.933 . . . . 0.0 109.973 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.555 ' CG1' HD21 ' A' ' 59' ' ' LEU . 9.8 p -64.57 -27.34 42.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.748 -1.569 . . . . 0.0 109.849 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.669 HD12 HD13 ' A' ' 103' ' ' LEU . 6.1 mm -56.97 -56.15 16.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.066 167.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.9 tm0? -67.2 -34.64 77.93 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.791 -175.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -65.53 -48.95 70.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.477 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.421 ' HB ' HD11 ' A' ' 103' ' ' LEU . 20.6 m -63.68 -39.25 93.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.331 0.586 . . . . 0.0 110.14 178.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.45 -43.81 93.1 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.716 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.9 t -62.39 -33.98 75.82 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.734 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -75.33 -43.45 50.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.815 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.859 ' HB2' HD13 ' A' ' 48' ' ' ILE . . . -69.92 -7.12 37.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.444 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.667 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 25.0 ttpp -68.13 -11.32 58.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.101 0.476 . . . . 0.0 109.912 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -140.95 -24.11 0.76 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.388 172.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.667 ' HB3' ' HA ' ' A' ' 42' ' ' ALA . 13.0 t -65.77 115.15 5.6 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.404 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 71.3 t80 66.36 4.14 3.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.945 0.879 . . . . 0.0 108.904 -173.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.432 ' C ' HD13 ' A' ' 49' ' ' LEU . 3.0 m 44.93 69.73 0.41 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 113.899 -1.5 . . . . 0.0 111.679 -173.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.859 HD13 ' HB2' ' A' ' 42' ' ' ALA . 50.7 mt -76.95 -67.57 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.563 173.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 43' ' ' LYS . 4.1 mp 67.19 -47.5 0.48 Allowed 'General case' 0 N--CA 1.473 0.695 0 O-C-N 124.022 0.827 . . . . 0.0 112.98 176.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.0 m -53.81 130.66 37.76 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.746 0.419 . . . . 0.0 111.469 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 55.72 72.25 1.07 Allowed Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.287 -176.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -84.71 7.61 5.09 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.008 2.472 . . . . 0.0 111.535 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.403 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 1.6 p-10 -91.16 116.95 67.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.467 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.615 ' HB2' HE22 ' A' ' 32' ' ' GLN . 84.0 Cg_endo -85.53 2.23 7.81 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.082 2.521 . . . . 0.0 112.941 -171.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.9 p -85.44 -1.75 57.38 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.413 0.625 . . . . 0.0 110.815 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.572 ' C ' ' HG2' ' A' ' 106' ' ' LYS . 4.1 m-20 -120.88 9.88 10.75 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.191 -173.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.666 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 31.7 m-85 -115.17 166.0 12.31 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.96 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.59 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -142.85 171.41 9.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.578 171.432 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.76 HD23 ' HB3' ' A' ' 101' ' ' PHE . 9.7 tp -124.0 145.48 49.17 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.789 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.7 mm? -98.78 130.34 45.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.631 179.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.593 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.7 pt-20 -95.55 84.92 4.05 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.404 1.097 . . . . 0.0 108.613 170.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.653 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 15.2 tt0 -85.62 124.23 31.93 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 121.465 -0.772 . . . . 0.0 108.961 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.512 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -114.46 110.09 30.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.515 HG22 ' HA3' ' A' ' 99' ' ' GLY . 61.3 t -81.57 113.75 21.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.721 -176.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -98.82 59.6 1.22 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.692 0.758 . . . . 0.0 109.353 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.47 133.9 47.26 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.722 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 7.6 t -143.9 128.85 18.49 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.988 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.7 p -129.08 8.77 5.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.501 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -74.44 -51.62 14.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.441 -176.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -73.03 -79.86 0.07 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.608 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.1 pttp 178.16 106.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.473 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.1 m -138.44 126.64 22.87 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.242 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 m -63.93 -52.04 61.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.938 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.437 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 33.2 p -135.37 138.01 27.75 Favored Pre-proline 0 C--O 1.235 0.339 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.883 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 36.6 Cg_exo -61.13 157.66 38.46 Favored 'Trans proline' 0 CA--C 1.519 -0.25 0 C-N-CA 123.177 2.584 . . . . 0.0 112.477 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -113.09 112.0 23.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.482 -174.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.6 m -96.94 103.7 15.65 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.542 176.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 m -82.23 99.53 9.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.549 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 25.8 tt0 -95.44 131.98 41.01 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 -174.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.465 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 21.7 tpp85 -129.1 159.98 34.28 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.786 HG13 HG13 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -118.21 145.77 23.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 118.442 0.565 . . . . 0.0 111.149 -175.669 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.438 HD13 ' HB3' ' A' ' 59' ' ' LEU . 42.4 mt -101.62 177.22 4.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.918 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' ASP . 30.4 tp -113.98 -49.39 2.86 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.929 0.492 . . . . 0.0 110.408 -175.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LEU . 3.5 p-10 178.46 -45.79 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.664 172.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.651 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 3.0 pt20 -117.35 34.65 5.02 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.0 mp0 -65.73 -14.78 61.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.863 -0.153 . . . . 0.0 111.213 173.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 68.2 m 66.88 104.87 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.558 0 O-C-N 123.795 0.684 . . . . 0.0 110.131 -174.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.529 ' H ' ' HA ' ' A' ' 30' ' ' THR . 15.2 m -74.79 -30.76 24.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -173.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -72.63 -37.86 67.91 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.554 -0.858 . . . . 0.0 108.804 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.671 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 9.0 mm100 -65.02 -43.54 92.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.913 173.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.48 88.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 0.0 110.223 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -57.94 -42.29 84.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.57 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.5 p -72.84 -12.53 61.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.679 -177.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.671 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 70.0 mmtt -87.25 -16.32 35.56 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.196 0.522 . . . . 0.0 110.823 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.4 m0 -60.73 157.9 13.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.438 -176.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.415 ' H ' HG22 ' A' ' 63' ' ' VAL . 25.0 mtmm -129.85 28.3 5.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.725 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.47 ' O ' HG21 ' A' ' 63' ' ' VAL . . . -178.22 159.02 24.23 Favored Glycine 0 N--CA 1.442 -0.941 0 CA-C-N 113.802 -1.544 . . . . 0.0 109.644 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.482 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -81.62 106.8 13.86 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 117.504 0.652 . . . . 0.0 110.684 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.653 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -110.47 -151.96 13.05 Favored Glycine 0 N--CA 1.434 -1.471 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.033 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.448 ' HG3' ' C ' ' A' ' 99' ' ' GLY . 8.2 mtmt -149.79 144.2 25.86 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.76 ' HB3' HD23 ' A' ' 59' ' ' LEU . 86.2 m-85 -82.11 152.55 26.5 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.315 169.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.789 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 76.2 mt -138.67 126.4 27.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.176 -0.327 . . . . 0.0 111.072 -174.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.669 HD13 HD12 ' A' ' 35' ' ' ILE . 4.7 tp -75.57 134.63 40.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.6 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 8.4 tppt? -150.52 176.32 11.07 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.666 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.3 tp -103.69 139.19 39.29 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.59 ' CA ' HG23 ' A' ' 58' ' ' VAL . 17.5 ptmt -83.85 -34.21 24.68 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.009 -174.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.491 ' HA ' ' OE1' ' A' ' 110' ' ' GLN . 12.8 pt-20 -70.99 -2.61 15.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.421 0.629 . . . . 0.0 109.919 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.561 ' HG3' ' HB3' ' A' ' 116' ' ' LYS . 8.6 tt0 -106.25 -18.68 13.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.442 176.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.786 HG13 HG13 ' A' ' 81' ' ' VAL . 16.8 t -104.24 -19.04 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.527 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.53 ' C ' ' H ' ' A' ' 112' ' ' SER . 16.1 pt20 -67.11 76.45 0.13 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.257 0.551 . . . . 0.0 111.693 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 68.06 -8.89 0.52 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.031 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.53 ' H ' ' C ' ' A' ' 110' ' ' GLN . 56.5 m 62.12 79.17 0.26 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.429 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.0 mmm180 -84.17 117.61 23.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.072 173.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 67.86 -177.3 0.21 Allowed 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.955 0.784 . . . . 0.0 110.492 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -103.95 132.65 50.0 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.561 ' HB3' ' HG3' ' A' ' 108' ' ' GLN . 55.3 tttp . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.372 -177.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.2 p . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m -90.79 97.1 10.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 170.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -77.63 -21.15 52.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.223 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -94.37 175.44 6.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.221 175.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.681 ' HB2' ' HD3' ' A' ' 27' ' ' ARG . 13.4 pt-20 -102.72 110.42 22.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.847 0.832 . . . . 0.0 109.925 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.45 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 49.8 p -123.39 145.06 49.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.077 -175.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.767 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.8 p90 -135.15 147.02 49.33 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -85.68 137.06 33.09 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.113 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.447 HG21 ' CE2' ' A' ' 7' ' ' PHE . 1.2 t -123.43 142.65 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.078 0.466 . . . . 0.0 110.477 176.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.455 ' HB3' HD13 ' A' ' 20' ' ' LEU . 38.9 mt-30 -110.62 107.38 16.95 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 166.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -123.18 139.11 50.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -177.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.467 ' HB2' HG12 ' A' ' 102' ' ' ILE . 10.5 m-70 -87.82 112.21 22.22 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.736 179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -91.51 171.49 9.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 171.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.9 t -79.58 -18.34 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.773 0.321 . . . . 0.0 110.735 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.756 ' HA ' ' HB2' ' A' ' 46' ' ' TYR . 13.7 m -62.93 138.85 97.32 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-O 121.507 0.67 . . . . 0.0 111.124 179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -87.41 -7.21 6.84 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.546 2.83 . . . . 0.0 112.656 -175.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -73.43 -22.41 60.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.682 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.485 ' HG3' ' HA ' ' A' ' 21' ' ' THR . 6.7 tp-100 -154.23 89.54 3.32 Favored Pre-proline 0 C--N 1.32 -0.674 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' A' ' 18' ' ' GLN . 7.0 Cg_endo -48.82 -63.58 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.322 2.681 . . . . 0.0 111.539 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.455 HD13 ' HB3' ' A' ' 10' ' ' GLN . 65.4 tp -90.15 93.36 9.34 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.485 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.3 m -70.33 109.2 4.58 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.666 -177.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.0 121.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 pt -129.71 164.3 32.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.745 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.45 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 28.7 tttp -118.14 105.27 11.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.03 169.24 6.55 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.22 -174.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.732 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.3 Cg_endo -75.43 141.02 24.97 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 122.147 1.898 . . . . 0.0 111.993 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.767 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.7 mtp-105 -61.8 -6.17 2.5 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 122.147 0.975 . . . . 0.0 110.166 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.479 ' H ' ' C ' ' A' ' 26' ' ' PRO . 3.0 p -103.97 -20.52 5.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.194 -178.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.732 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 95.1 p -58.04 126.59 28.13 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 120.851 0.357 . . . . 0.0 110.08 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.441 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 28.4 p -94.78 -164.78 1.21 Allowed 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.459 ' HB2' HD12 ' A' ' 82' ' ' LEU . . . -61.94 -50.18 73.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.83 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.546 ' NE2' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -59.59 -33.95 72.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.102 0.477 . . . . 0.0 110.48 -179.196 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -69.26 -53.26 20.75 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 122.163 0.982 . . . . 0.0 109.599 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.448 ' CG1' HD21 ' A' ' 59' ' ' LEU . 5.6 p -68.84 -28.24 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 CA-C-N 113.352 -1.749 . . . . 0.0 110.357 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.684 HD12 ' HG ' ' A' ' 103' ' ' LEU . 3.8 mm -57.16 -57.77 8.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.366 171.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.548 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 33.2 tt0 -68.06 -33.61 74.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.003 -175.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -59.29 -42.64 91.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.2 m -70.14 -37.04 75.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.917 176.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 3.5 mp -52.59 -47.45 66.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.327 0.584 . . . . 0.0 110.59 172.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.55 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 16.1 t -69.97 -29.28 66.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.212 -176.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -81.88 -30.19 32.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.494 ' C ' ' H ' ' A' ' 44' ' ' TYR . . . -103.65 18.02 22.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.808 -176.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 40' ' ' CYS . 18.5 pttp -71.05 30.84 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.495 ' HA ' HD12 ' A' ' 49' ' ' LEU . 15.3 p90 179.12 -20.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.036 0.534 . . . . 0.0 109.972 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.419 ' C ' ' H ' ' A' ' 47' ' ' SER . 10.6 t -60.82 -69.51 0.23 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.911 -176.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.756 ' HB2' ' HA ' ' A' ' 15' ' ' SER . 74.1 t80 -85.1 9.26 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 167.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.438 ' HA ' ' HA ' ' A' ' 44' ' ' TYR . 13.1 m 62.54 54.39 2.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 113.852 -1.522 . . . . 0.0 110.395 -173.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.0 mm -81.1 62.76 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 122.03 0.919 . . . . 0.0 109.207 174.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 44' ' ' TYR . 5.1 mp -105.66 -24.03 12.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.287 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.6 m -64.34 -36.65 84.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.774 -176.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -123.27 97.89 42.28 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -87.5 -14.09 3.93 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.488 2.125 . . . . 0.0 113.617 -176.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.485 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -96.46 132.16 27.01 Favored Pre-proline 0 N--CA 1.454 -0.241 0 CA-C-O 121.745 0.783 . . . . 0.0 110.986 -176.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.546 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 86.9 Cg_endo -91.72 3.57 4.09 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.833 2.355 . . . . 0.0 112.745 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.622 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 19.2 m -75.73 -10.09 59.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.217 -177.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.606 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 11.7 m-20 -99.19 -1.52 39.06 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.972 0.415 . . . . 0.0 110.265 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.523 ' HB3' HD11 ' A' ' 35' ' ' ILE . 50.6 m-85 -101.54 145.1 29.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.653 -174.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.568 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -131.63 144.16 38.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.888 165.649 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.787 HD23 ' HB3' ' A' ' 101' ' ' PHE . 18.4 tp -97.03 142.56 28.82 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.407 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 HG11 ' A' ' 81' ' ' VAL . 1.4 mm? -98.44 129.62 45.06 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 176.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.65 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 12.4 pt-20 -93.25 87.76 5.78 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 170.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.617 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 3.5 tt0 -85.61 125.04 32.82 Favored 'General case' 0 N--CA 1.425 -1.694 0 O-C-N 121.045 -1.034 . . . . 0.0 109.783 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.613 HG23 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.82 112.65 39.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.322 0.582 . . . . 0.0 110.468 175.893 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.482 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.7 t -76.44 105.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.437 176.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -115.82 87.33 2.65 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 122.038 0.923 . . . . 0.0 108.994 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.42 ' HB2' ' HA ' ' A' ' 75' ' ' PRO . 7.5 p-10 -94.93 174.4 7.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.93 -173.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.8 t -110.83 104.19 12.79 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 121.749 0.785 . . . . 0.0 108.988 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.9 m -83.09 -28.95 29.13 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.257 -177.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -69.28 -57.34 5.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.989 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -96.27 132.44 41.74 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.905 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.65 ' HB3' ' HZ3' ' A' ' 71' ' ' LYS . 5.9 mmmp? -120.9 33.5 5.54 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.8 t -78.79 -22.72 45.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.148 0.499 . . . . 0.0 109.829 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 t -123.8 -179.02 4.22 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.684 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 39.1 p -105.16 156.88 35.46 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.609 0.242 . . . . 0.0 111.045 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.42 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 68.8 Cg_exo -55.76 132.54 52.68 Favored 'Trans proline' 0 CA--C 1.516 -0.395 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 173.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.532 ' HZ2' ' HB3' ' A' ' 76' ' ' LYS . 10.3 mtpm? -125.18 134.44 52.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.75 0.786 . . . . 0.0 112.128 -172.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.482 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 54.4 p -92.61 118.55 31.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.7 m -94.04 101.76 13.81 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.27 131.47 39.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.72 -175.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.498 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 33.8 ttt180 -124.63 153.85 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.852 HG12 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -109.26 130.17 62.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.552 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.526 HD11 ' HB3' ' A' ' 59' ' ' LEU . 21.2 mt -85.83 165.65 16.67 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.515 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 75.0 mt -84.39 178.93 7.56 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 166.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 33.5 m-20 -55.22 -48.33 74.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.191 0.519 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -121.69 50.78 1.38 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.121 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.463 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -71.82 -3.96 25.19 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 174.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 32.6 m 66.11 104.69 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.188 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.441 ' H ' ' HA ' ' A' ' 30' ' ' THR . 23.6 m -74.45 -26.25 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.508 0 O-C-N 122.228 -0.295 . . . . 0.0 111.641 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -71.97 -35.18 69.44 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.479 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -66.32 -48.15 71.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.199 175.123 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.409 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -54.4 -48.83 71.14 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.969 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -56.94 -47.94 79.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.46 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.6 p -70.61 -6.67 38.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.448 0.642 . . . . 0.0 110.839 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 25.9 ttpp -106.66 0.25 24.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.106 -176.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.413 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -74.22 157.39 35.97 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.754 0.787 . . . . 0.0 112.906 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.613 ' H ' HG23 ' A' ' 63' ' ' VAL . 3.6 mppt? -120.65 23.78 10.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.22 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 176.28 -175.06 47.36 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.344 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -99.46 104.99 16.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 117.386 0.593 . . . . 0.0 111.092 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.617 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -111.56 -145.98 10.22 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.42 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.37 145.46 13.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.225 0.61 . . . . 0.0 109.636 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.787 ' HB3' HD23 ' A' ' 59' ' ' LEU . 93.4 m-85 -79.96 140.8 36.49 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.991 175.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.467 HG12 ' HB2' ' A' ' 12' ' ' HIS . 70.0 mt -129.03 125.69 63.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 122.187 -0.321 . . . . 0.0 111.246 -173.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.684 ' HG ' HD12 ' A' ' 35' ' ' ILE . 6.4 mp -73.86 128.35 35.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.023 0.439 . . . . 0.0 111.219 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.504 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 21.1 ttmm -145.72 177.87 8.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.504 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 18.1 mt -108.87 143.41 38.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.374 0.607 . . . . 0.0 112.041 179.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.622 ' HD3' ' O ' ' A' ' 55' ' ' SER . 18.9 ptmt -83.56 -16.55 44.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.326 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -73.27 -13.31 61.11 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.741 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -105.55 -43.53 4.92 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.852 HG12 HG12 ' A' ' 81' ' ' VAL . 80.1 t -78.33 77.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.206 170.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 112' ' ' SER . 2.8 pt20 -111.47 32.8 5.11 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.116 -171.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 72.7 -19.23 0.31 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.497 0.719 . . . . 0.0 112.55 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.45 ' H ' ' C ' ' A' ' 110' ' ' GLN . 85.1 p 61.13 136.64 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.968 1.307 . . . . 0.0 112.865 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -25.18 59.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.652 -179.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -91.86 20.26 5.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.46 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -64.63 111.19 2.62 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' A' ' 116' ' ' LYS . 10.6 mmpt? . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.355 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 p -93.66 126.44 38.83 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.154 -0.314 . . . . 0.0 110.154 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -83.33 -23.03 32.72 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.945 0.403 . . . . 0.0 109.93 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -68.94 141.91 54.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.283 176.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 35.6 tt0 -102.16 124.34 47.58 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.597 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.4 140.49 31.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.078 0.466 . . . . 0.0 110.415 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.596 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 3.4 p90 -106.13 155.78 19.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -176.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -90.88 137.01 32.69 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.255 -174.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.567 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.2 t -122.49 141.0 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.625 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.548 ' HB3' HD12 ' A' ' 20' ' ' LEU . 45.8 mt-30 -111.43 109.24 19.11 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 165.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.719 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.4 p -135.83 137.9 48.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.776 0.322 . . . . 0.0 111.131 -173.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.405 ' HE2' ' HD3' ' A' ' 100' ' ' LYS . 59.0 m-70 -97.92 170.04 9.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 111.195 -177.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -143.93 -176.82 5.14 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 170.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.02 -22.66 6.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.412 0.625 . . . . 0.0 109.317 175.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.0 t -64.59 132.98 95.56 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.778 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.735 ' HD2' ' HB2' ' A' ' 46' ' ' TYR . 77.7 Cg_endo -78.11 -173.95 2.04 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 123.227 2.618 . . . . 0.0 112.524 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 67.81 96.64 0.06 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.786 -175.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.562 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 10.6 mm-40 67.69 81.99 0.2 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.53 -172.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.18 -45.4 27.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.146 2.564 . . . . 0.0 112.671 -177.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.548 HD12 ' HB3' ' A' ' 10' ' ' GLN . 60.1 tp -90.17 105.94 18.15 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 25.7 m -80.14 108.92 14.12 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.197 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.44 114.92 33.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.471 0.653 . . . . 0.0 109.512 177.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.567 HG13 ' HB ' ' A' ' 9' ' ' VAL . 14.1 pt -124.77 174.15 9.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.985 -176.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -124.42 96.88 5.07 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 171.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.87 163.65 17.37 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.7 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.943 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.2 Cg_endo -70.08 144.16 51.47 Favored 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 121.925 1.75 . . . . 0.0 111.99 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.596 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 52.1 mtp180 -61.02 -8.82 3.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.394 0.616 . . . . 0.0 110.729 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -106.99 -5.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.99 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.943 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -56.2 126.64 27.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.55 0.69 . . . . 0.0 110.961 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.525 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -107.1 -179.15 3.85 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.057 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.69 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.56 -48.82 27.69 Favored 'General case' 0 C--O 1.211 -0.934 0 O-C-N 123.484 0.49 . . . . 0.0 111.822 -172.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.626 ' HA ' HD13 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.46 -27.18 63.08 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.864 -177.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.83 -52.41 30.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 122.004 0.907 . . . . 0.0 108.978 176.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.439 ' CG1' HG23 ' A' ' 88' ' ' VAL . 2.7 p -67.38 -26.89 37.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.125 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.69 HG13 ' O ' ' A' ' 31' ' ' ALA . 8.4 mt -55.7 -57.55 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.261 169.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.53 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.0 tt0 -65.45 -32.65 74.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.831 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.445 ' HG2' HD13 ' A' ' 23' ' ' ILE . 45.5 tp60 -61.73 -45.15 95.19 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.165 0.507 . . . . 0.0 110.137 175.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.511 ' HB ' HD23 ' A' ' 103' ' ' LEU . 20.5 m -69.05 -38.39 79.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.89 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -50.65 -42.25 56.28 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.214 0.531 . . . . 0.0 110.67 171.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.36 -46.56 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.505 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -79.92 -19.91 46.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -90.66 13.21 16.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.878 0.371 . . . . 0.0 110.573 177.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.645 ' HA ' HD23 ' A' ' 49' ' ' LEU . 36.6 ttmt -58.12 102.78 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.259 -176.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.483 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 98.3 m-85 58.27 27.36 15.11 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.06 179.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.2 m -73.23 -85.3 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.735 ' HB2' ' HD2' ' A' ' 16' ' ' PRO . 57.9 t80 -95.64 12.85 28.28 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.9 t 63.92 83.95 0.16 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.581 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.49 ' O ' HG23 ' A' ' 48' ' ' ILE . 41.7 mm -103.28 18.67 4.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 123.043 1.402 . . . . 0.0 107.728 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.645 HD23 ' HA ' ' A' ' 43' ' ' LYS . 2.1 mm? -102.26 10.02 39.55 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.129 -166.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -67.59 -33.38 74.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 174.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -122.72 90.19 49.94 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.609 169.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.57 13.94 2.53 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.491 2.127 . . . . 0.0 111.641 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.468 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.9 p-10 -107.81 136.44 19.7 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.101 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.486 ' HA ' HG22 ' A' ' 35' ' ' ILE . 6.3 Cg_exo -78.68 16.66 1.25 Allowed 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.928 2.419 . . . . 0.0 111.873 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.2 m -87.15 -36.36 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.486 -173.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.519 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 32.3 m-20 -102.2 18.17 21.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.241 0.543 . . . . 0.0 111.298 -173.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 11.8 m-85 -116.5 177.85 4.55 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.616 0.722 . . . . 0.0 110.63 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.504 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -148.26 -179.73 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.844 170.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.978 HD13 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -144.27 139.96 28.92 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.604 HD12 HG12 ' A' ' 81' ' ' VAL . 2.3 mm? -104.0 127.86 51.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.896 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.556 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.3 pt-20 -94.3 86.35 4.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.432 1.111 . . . . 0.0 108.39 167.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 0.7 OUTLIER -86.71 123.66 32.12 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.078 175.232 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.544 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -115.64 118.33 58.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.224 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.512 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 84.4 t -68.94 109.33 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.231 0.539 . . . . 0.0 110.815 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 65' ' ' LYS . 25.3 mmmt -115.94 90.81 3.42 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.018 175.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.463 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 4.9 p-10 -58.46 169.65 0.87 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.984 -170.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.411 HG22 ' HB ' ' A' ' 72' ' ' THR . 2.1 t -107.24 91.5 3.68 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.378 174.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.1 m -64.96 -24.66 67.58 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 0.0 109.513 176.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -87.56 -154.47 0.26 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.945 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -124.15 96.85 5.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 120.369 -0.533 . . . . 0.0 112.058 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 71' ' ' LYS . 24.1 mtpp -131.85 -3.58 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.001 170.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.56 HG23 ' H ' ' A' ' 74' ' ' THR . 37.1 m -157.74 148.71 21.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 9.9 t -72.24 -17.69 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.615 0.245 . . . . 0.0 111.538 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.56 ' H ' HG23 ' A' ' 72' ' ' THR . 16.2 p -137.51 160.19 66.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.324 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -51.02 127.83 22.96 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.239 1.96 . . . . 0.0 111.213 171.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.463 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 20.6 pttp -100.16 147.66 25.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.828 -167.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.1 m -99.27 137.51 37.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.442 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.4 t -102.54 99.25 9.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 6.0 tt0 -94.97 132.05 40.24 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.028 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -129.22 144.09 51.09 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.724 HG13 HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -103.78 141.1 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 118.71 0.686 . . . . 0.0 110.928 -178.024 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.639 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 7.8 mt -101.27 156.81 17.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.521 -176.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.42 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.6 mp -86.1 171.83 11.05 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 165.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.47 -31.38 55.62 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -176.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 6.9 pt20 -121.47 33.13 5.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -176.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.639 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 11.7 mm-40 -72.58 -11.74 60.77 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.565 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 55.5 m 68.08 118.61 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.403 0.621 . . . . 0.0 111.931 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.49 ' H ' ' HA ' ' A' ' 30' ' ' THR . 91.7 t -75.78 -37.08 34.76 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.864 -175.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -72.74 -38.78 67.28 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.565 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 18.1 mt-30 -58.36 -45.71 87.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.309 172.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.527 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.35 -50.99 70.7 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.117 178.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.448 ' OE1' ' HE2' ' A' ' 101' ' ' PHE . 12.1 tt0 -59.35 -24.97 63.81 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.674 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -82.93 -9.21 59.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.129 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.527 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 80.3 mttt -86.53 -24.18 25.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.201 0.524 . . . . 0.0 110.538 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -56.16 143.49 33.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.984 -1.007 . . . . 0.0 113.168 -168.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -124.87 20.21 8.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.255 -1.338 . . . . 0.0 108.891 177.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.494 ' O ' HG21 ' A' ' 63' ' ' VAL . . . -168.17 155.22 25.78 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 108.526 -1.83 . . . . 0.0 108.526 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.04 103.92 11.18 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 118.08 0.94 . . . . 0.0 111.256 -176.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.549 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -109.64 -147.66 11.97 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.725 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.405 ' HD3' ' HE2' ' A' ' 12' ' ' HIS . 0.0 OUTLIER -156.01 155.05 32.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.002 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.978 ' HB3' HD13 ' A' ' 59' ' ' LEU . 94.8 m-85 -85.35 151.4 24.05 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 168.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.559 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.5 mp -131.01 125.87 58.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 O-C-N 121.829 -0.544 . . . . 0.0 110.054 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.511 HD23 ' HB ' ' A' ' 38' ' ' THR . 25.0 tp -80.61 133.63 35.78 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -146.93 159.68 43.26 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.549 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.8 OUTLIER -82.89 150.77 26.3 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.634 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.504 ' CA ' HG23 ' A' ' 58' ' ' VAL . 13.2 ptmm? -78.11 -24.09 47.64 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.453 0.644 . . . . 0.0 109.307 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -77.09 3.79 11.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.942 169.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -122.8 1.07 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.724 HG22 HG13 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -116.82 -4.11 11.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.966 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -61.59 82.61 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.847 0.832 . . . . 0.0 113.014 -167.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.05 3.52 38.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.245 170.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.5 t -80.78 164.4 22.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.847 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.9 mmt85 -67.54 -37.76 83.2 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -140.98 142.89 34.24 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.437 176.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.05 -28.02 12.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.258 0.551 . . . . 0.0 110.395 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.9 mttp . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.797 -177.84 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.1 p . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 121.065 0.46 . . . . 0.0 110.696 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.1 t -143.34 -167.84 2.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.122 -174.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -100.11 -4.14 30.37 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.982 0.42 . . . . 0.0 110.024 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -83.06 10.18 8.64 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.53 0.681 . . . . 0.0 110.554 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 5' ' ' GLU . 7.6 pt-20 -113.43 122.77 48.33 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.81 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p -154.9 140.31 17.75 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.6 ' HE1' ' HG ' ' A' ' 29' ' ' SER . 7.2 p90 -132.21 152.18 51.44 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -85.86 129.76 34.74 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.023 0.439 . . . . 0.0 111.396 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.551 HG21 ' CE2' ' A' ' 7' ' ' PHE . 2.0 t -118.1 118.03 56.8 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.323 178.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.592 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 80.6 mt-30 -90.56 108.04 19.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 164.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.788 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -121.66 114.33 42.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 121.653 0.74 . . . . 0.0 111.135 -178.888 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.627 ' CD2' HD12 ' A' ' 20' ' ' LEU . 16.7 m-70 -71.43 141.03 50.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.905 -178.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -109.41 162.02 14.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 171.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.63 -21.35 7.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.449 0.643 . . . . 0.0 110.018 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.613 ' HB2' ' HB3' ' A' ' 46' ' ' TYR . 1.2 m -83.52 146.99 51.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.965 -175.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -82.89 134.78 7.34 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.418 2.078 . . . . 0.0 112.734 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 168.16 -56.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -154.64 96.64 2.58 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 113.451 -1.704 . . . . 0.0 106.934 169.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -47.77 -37.89 28.89 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.383 2.722 . . . . 0.0 112.978 -169.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.627 HD12 ' CD2' ' A' ' 12' ' ' HIS . 41.0 tp -107.47 109.68 21.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.081 177.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 21.6 m -85.58 108.45 17.97 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.425 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.4 t -94.22 111.78 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 O-C-N 122.055 -0.403 . . . . 0.0 110.306 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.5 pt -123.15 170.3 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.161 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 tttt -119.16 113.73 21.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.402 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -115.43 168.49 8.22 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.742 -176.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.898 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.6 Cg_endo -75.38 143.46 27.91 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.01 1.807 . . . . 0.0 111.568 -179.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.56 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 67.2 mtt180 -59.31 -18.37 37.27 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.506 0.67 . . . . 0.0 110.495 -176.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.38 -14.34 9.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.137 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.898 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.1 p -55.42 128.52 34.68 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.753 0.787 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.645 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.5 t -111.23 177.55 4.62 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.364 176.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -49.78 -52.77 29.51 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 123.642 0.589 . . . . 0.0 111.306 -171.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.771 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -57.17 -34.92 68.95 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.721 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.47 -52.4 10.78 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.467 0.651 . . . . 0.0 110.523 -175.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.711 HG12 HD21 ' A' ' 59' ' ' LEU . 3.3 p -62.54 -27.62 43.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.064 177.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.719 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.6 mm -56.01 -57.29 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.976 172.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.429 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 10.1 tt0 -71.82 -32.55 67.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -177.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -56.94 -37.77 71.99 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.04 0.448 . . . . 0.0 110.077 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.0 m -70.52 -38.5 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.965 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 35' ' ' ILE . 9.2 mp -54.59 -43.62 72.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.851 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.46 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 51.2 t -71.07 -37.57 72.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.762 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -73.46 -25.43 60.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.885 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.711 ' HB3' ' HB2' ' A' ' 46' ' ' TYR . . . -108.52 17.21 22.29 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -172.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.528 ' C ' ' H ' ' A' ' 45' ' ' SER . 17.1 pttm -65.04 107.58 1.56 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.128 0.49 . . . . 0.0 110.978 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.843 ' HA ' HD23 ' A' ' 49' ' ' LEU . 85.4 m-85 71.07 -28.9 0.18 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.106 -177.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.528 ' H ' ' C ' ' A' ' 43' ' ' LYS . 25.3 m -53.71 -69.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.55 0.74 . . . . 0.0 110.9 176.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.711 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 26.9 m-85 -88.44 11.81 15.97 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 173.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.445 ' C ' HD21 ' A' ' 49' ' ' LEU . 1.1 m 54.8 39.86 31.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.355 -1.293 . . . . 0.0 110.906 -174.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.472 ' O ' HD11 ' A' ' 49' ' ' LEU . 38.5 mm -85.81 78.51 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.475 174.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.843 HD23 ' HA ' ' A' ' 44' ' ' TYR . 2.0 mm? -124.68 -23.61 4.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.6 m -57.91 -49.36 77.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.759 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -110.02 93.05 14.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 174.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -84.76 -3.08 9.84 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.89 2.393 . . . . 0.0 111.941 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -103.43 133.79 20.11 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.863 177.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.771 ' HB2' HE22 ' A' ' 32' ' ' GLN . 89.8 Cg_endo -85.59 5.35 6.15 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.658 2.239 . . . . 0.0 113.074 -175.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 15.5 p -85.26 -6.11 59.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.204 -175.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.514 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.2 m-20 -103.59 4.54 35.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.883 0.373 . . . . 0.0 110.552 175.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.582 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 61.1 m-85 -110.4 155.94 21.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 110.832 -177.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.541 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -143.02 146.75 21.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 170.267 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.776 HD23 ' HB3' ' A' ' 101' ' ' PHE . 16.1 tp -99.68 147.8 25.03 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.046 0.451 . . . . 0.0 110.803 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.4 mm? -106.1 133.34 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.594 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HB3' HD22 ' A' ' 82' ' ' LEU . 11.8 pt-20 -94.59 85.23 4.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.706 1.241 . . . . 0.0 108.484 170.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.609 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 14.6 tt0 -86.12 122.86 30.74 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.387 -0.82 . . . . 0.0 109.262 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.523 HG11 ' HB3' ' A' ' 78' ' ' SER . 0.9 OUTLIER -113.36 111.98 38.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-O 121.234 0.54 . . . . 0.0 110.173 176.552 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.622 HG22 ' HA3' ' A' ' 99' ' ' GLY . 79.7 t -70.56 99.78 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.177 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.601 ' HD3' ' HB2' ' A' ' 96' ' ' LYS . 24.6 mmmt -94.49 87.63 5.2 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.179 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -80.57 123.91 28.52 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.409 ' O ' ' HB ' ' A' ' 73' ' ' THR . 5.5 t -149.01 106.76 3.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.661 0.743 . . . . 0.0 111.418 -174.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.544 HG22 ' H ' ' A' ' 73' ' ' THR . 62.4 m -101.31 -57.88 2.0 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.122 171.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 62.66 -82.19 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.256 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -109.82 -78.99 0.58 Allowed 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.058 -170.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.623 ' HZ1' ' HB2' ' A' ' 71' ' ' LYS . 3.9 ttmp? -82.41 150.65 26.98 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 175.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.8 m -54.34 101.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.274 0.559 . . . . 0.0 110.757 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.544 ' H ' HG22 ' A' ' 68' ' ' THR . 17.7 m -121.9 128.9 52.09 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.376 -177.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.423 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 32.7 p -71.26 142.91 87.56 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.795 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 31.6 Cg_exo -60.14 148.13 90.7 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 123.003 2.469 . . . . 0.0 111.248 174.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.5 157.42 45.68 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.523 -171.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 57.0 m -118.1 103.77 10.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.616 174.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.523 ' HB3' HG11 ' A' ' 63' ' ' VAL . 20.7 t -80.29 99.35 7.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.597 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.25 131.26 40.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.525 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 35.6 ttt-85 -128.35 152.73 47.82 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.872 HG13 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.92 144.23 16.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.988 0.813 . . . . 0.0 110.719 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 61' ' ' GLU . 16.9 mt -100.17 158.8 15.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.284 -176.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.8 mp -92.46 -179.19 5.13 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.0 -52.3 34.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.302 0.377 . . . . 0.0 111.337 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.645 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 14.0 pt20 -119.52 51.59 1.15 Allowed 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.6 tp10 -73.12 -21.17 60.78 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.101 0.477 . . . . 0.0 109.738 170.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.672 ' HB2' HE21 ' A' ' 90' ' ' GLN . 54.9 m 73.7 124.98 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.267 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.479 ' H ' ' HA ' ' A' ' 30' ' ' THR . 89.4 t -75.05 -42.94 45.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.521 -173.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 92.9 t80 -73.02 -33.38 65.71 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.672 HE21 ' HB2' ' A' ' 87' ' ' CYS . 14.5 mt-30 -64.12 -41.25 97.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.568 172.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.182 0.515 . . . . 0.0 110.386 176.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -63.39 -28.66 70.14 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.643 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.8 p -78.65 -6.8 56.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.874 0.369 . . . . 0.0 110.934 178.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 34.3 mmtp -88.19 -22.04 24.24 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.302 0.573 . . . . 0.0 109.829 176.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.417 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.5 m0 -62.3 148.29 45.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.866 -173.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.601 ' HB2' ' HD3' ' A' ' 65' ' ' LYS . 95.1 mttt -117.59 13.1 14.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.122 178.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -167.58 173.8 42.64 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.08 100.46 13.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 117.777 0.789 . . . . 0.0 111.208 -176.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.622 ' HA3' HG22 ' A' ' 64' ' ' VAL . . . -104.3 -145.11 13.91 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.997 -178.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.592 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -153.2 153.16 32.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 174.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.788 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.3 m-85 -87.95 122.59 31.75 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 170.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.603 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -101.19 123.61 54.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 O-C-N 121.81 -0.556 . . . . 0.0 110.444 -171.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.589 HD13 HD12 ' A' ' 35' ' ' ILE . 6.0 tp -74.99 127.19 32.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.566 ' HD2' HG21 ' A' ' 109' ' ' VAL . 15.5 ttmm -147.03 170.25 17.53 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.582 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.1 mp -95.98 160.11 14.63 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 175.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.541 ' HB3' HG23 ' A' ' 58' ' ' VAL . 10.9 ptmm? -89.06 -5.6 57.74 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 122.11 0.957 . . . . 0.0 109.6 175.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.68 -17.87 34.77 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.361 166.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.488 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 96.5 mt-30 -95.87 -40.14 9.46 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.872 HG12 HG13 ' A' ' 81' ' ' VAL . 76.1 t -88.76 72.38 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 113.988 -1.46 . . . . 0.0 108.85 167.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.465 ' C ' ' H ' ' A' ' 112' ' ' SER . 1.3 mm-40 -110.63 -161.28 0.75 Allowed 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.95 41.93 0.61 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.465 ' H ' ' C ' ' A' ' 110' ' ' GLN . 15.8 m -44.98 109.67 0.18 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 113.879 -1.509 . . . . 0.0 113.426 -167.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.418 ' HA ' ' NE ' ' A' ' 113' ' ' ARG . 4.4 mmp_? -86.18 99.83 11.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 170.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 113' ' ' ARG . 44.7 mt-10 75.23 -52.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.445 0 O-C-N 124.018 0.824 . . . . 0.0 111.065 -174.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -158.45 149.12 20.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.483 0.182 . . . . 0.0 110.896 177.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 123.646 0.778 . . . . 0.0 112.286 178.983 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.3 m . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 120.899 0.381 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -110.14 178.33 4.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.287 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -90.25 -15.62 30.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.408 0.623 . . . . 0.0 109.862 177.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -88.01 10.57 18.58 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.48 -173.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 5' ' ' GLU . 5.7 pt-20 -124.29 111.25 15.6 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.724 0.773 . . . . 0.0 111.873 -173.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.9 p -150.37 139.48 21.12 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.316 -0.857 . . . . 0.0 109.1 170.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.671 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.3 p90 -137.74 155.04 49.5 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -177.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -90.21 133.74 34.73 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.063 0.459 . . . . 0.0 111.586 -174.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -119.52 121.23 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.274 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.542 ' HB3' HD12 ' A' ' 20' ' ' LEU . 95.9 mt-30 -95.56 108.45 20.7 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 166.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.752 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -125.43 123.44 64.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.393 0.616 . . . . 0.0 111.092 -175.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.551 ' HB2' HG13 ' A' ' 102' ' ' ILE . 63.2 m-70 -79.19 150.41 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.695 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -120.52 172.82 7.56 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 169.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.18 -21.7 9.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.083 0.468 . . . . 0.0 110.523 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.6 ' HB2' ' HD2' ' A' ' 46' ' ' TYR . 4.6 m -77.36 160.68 74.85 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.285 -176.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.49 ' HB2' ' H ' ' A' ' 17' ' ' GLU . 85.3 Cg_endo -79.18 -141.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.781 2.321 . . . . 0.0 112.612 177.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 16' ' ' PRO . 10.3 tp10 72.39 -66.81 0.29 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.464 0.706 . . . . 0.0 110.33 -175.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.449 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.3 tp60 -148.07 94.83 4.23 Favored Pre-proline 0 C--N 1.317 -0.837 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.87 -41.92 25.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.564 2.843 . . . . 0.0 113.165 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.542 HD12 ' HB3' ' A' ' 10' ' ' GLN . 58.3 tp -101.13 107.89 19.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.838 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.6 m -77.5 144.97 37.3 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 174.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.0 t -125.99 118.08 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.554 HG13 ' HB ' ' A' ' 9' ' ' VAL . 7.3 pt -127.41 169.48 18.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 tttt -120.59 104.16 9.72 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 171.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.553 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -102.35 170.02 6.87 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.792 -175.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.891 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 3.8 Cg_endo -75.75 142.65 25.89 Favored 'Trans proline' 0 N--CA 1.446 -1.321 0 C-N-CA 122.007 1.804 . . . . 0.0 111.302 178.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.671 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 77.9 mtt180 -59.89 -15.62 22.79 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.219 0.533 . . . . 0.0 110.82 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.91 -12.58 8.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.841 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.891 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.9 p -54.69 127.19 27.08 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.63 0.729 . . . . 0.0 110.829 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.686 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.5 t -107.95 -179.08 3.79 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.83 -51.52 29.07 Favored 'General case' 0 C--O 1.212 -0.897 0 O-C-N 123.579 0.549 . . . . 0.0 110.862 -172.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -37.8 69.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -70.7 -53.37 15.89 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 122.234 1.016 . . . . 0.0 109.966 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.646 HG12 HD23 ' A' ' 59' ' ' LEU . 3.0 p -66.05 -27.23 40.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 113.525 -1.67 . . . . 0.0 110.175 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.554 HD12 HD13 ' A' ' 103' ' ' LEU . 3.7 mm -56.12 -57.32 8.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.797 172.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.536 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 4.6 tp-100 -69.25 -33.6 73.5 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.553 HE22 ' HA ' ' A' ' 25' ' ' ALA . 32.6 tt0 -60.41 -42.3 95.72 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.859 0.361 . . . . 0.0 110.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.1 m -67.34 -37.07 82.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.046 174.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.536 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -55.18 -41.9 72.5 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.131 0.491 . . . . 0.0 110.611 172.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 52.5 t -72.65 -34.28 67.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.886 -178.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -74.3 -39.29 63.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.013 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.648 ' HB2' ' HB2' ' A' ' 46' ' ' TYR . . . -96.1 0.25 51.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -172.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 40' ' ' CYS . 20.2 pttm -61.95 118.1 6.82 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.095 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.826 ' HA ' HD23 ' A' ' 49' ' ' LEU . 83.5 m-85 71.63 -41.64 0.51 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.933 0.893 . . . . 0.0 111.037 -176.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.458 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 29.5 m -50.4 -67.25 0.27 Allowed 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.782 0.833 . . . . 0.0 111.358 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.648 ' HB2' ' HB2' ' A' ' 42' ' ' ALA . 5.8 m-85 -92.39 19.85 6.75 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.442 ' C ' HD21 ' A' ' 49' ' ' LEU . 3.8 p 44.82 44.3 7.63 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.605 -170.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.505 ' O ' HD11 ' A' ' 49' ' ' LEU . 46.6 mm -86.49 75.16 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.482 174.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.826 HD23 ' HA ' ' A' ' 44' ' ' TYR . 1.7 mm? -122.51 -5.17 8.75 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.215 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 m -68.03 -50.56 54.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.214 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -117.28 94.51 45.32 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.4 175.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -84.6 0.87 8.91 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.696 2.264 . . . . 0.0 111.292 175.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -103.27 124.56 37.85 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.938 177.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.54 -2.4 12.44 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.912 2.408 . . . . 0.0 113.091 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.8 p -69.88 -23.68 63.3 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.522 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 18.0 m-20 -97.23 9.41 42.29 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.622 0.248 . . . . 0.0 111.574 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.575 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 43.0 m-85 -111.55 153.64 25.95 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.918 0.39 . . . . 0.0 110.738 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.586 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -140.58 142.69 30.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.059 169.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.646 HD23 HG12 ' A' ' 34' ' ' VAL . 15.8 tp -93.66 145.33 24.63 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.07 0.462 . . . . 0.0 110.412 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.687 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.7 mm? -107.04 129.4 54.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.831 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.672 ' HB3' HD23 ' A' ' 82' ' ' LEU . 15.4 pt-20 -91.13 85.34 5.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.565 1.174 . . . . 0.0 108.283 169.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.63 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 14.3 tt0 -86.29 123.82 31.97 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.632 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.556 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -117.77 116.29 51.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.864 175.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.524 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 95.6 t -65.66 104.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.675 0.75 . . . . 0.0 110.385 178.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.519 ' HG2' HG21 ' A' ' 63' ' ' VAL . 19.8 mmmt -111.28 98.38 7.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.171 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 4.0 p-10 -60.19 144.13 50.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.776 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.3 t -119.51 18.54 12.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.121 0.486 . . . . 0.0 110.302 -176.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 33.0 m -55.65 -67.03 0.32 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.786 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 57.33 -88.36 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.111 174.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -89.56 -40.72 12.44 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.505 -173.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HZ3' ' HB2' ' A' ' 71' ' ' LYS . 4.6 ttmp? -142.25 155.7 45.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.856 -173.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.9 m -48.1 107.42 0.12 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.279 0.562 . . . . 0.0 111.711 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.1 m -142.64 132.84 24.63 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.483 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 33.4 p -58.23 133.97 84.6 Favored Pre-proline 0 C--N 1.331 -0.232 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.549 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 25.3 Cg_exo -66.3 142.76 67.81 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.102 2.535 . . . . 0.0 112.284 178.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -112.33 165.73 11.93 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.98 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 2.0 p -116.41 103.79 10.8 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -75.82 99.03 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.221 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.599 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.8 tt0 -94.49 131.44 40.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -175.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.524 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 3.6 tmt_? -132.93 137.41 46.6 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 1.02 HG13 HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -98.05 137.41 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.679 -173.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.695 HD21 ' HG2' ' A' ' 86' ' ' GLU . 11.7 mt -94.04 168.64 10.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.258 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.42 HD11 ' N ' ' A' ' 83' ' ' LEU . 6.4 mp -107.82 -174.38 2.51 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.519 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -47.13 -53.71 12.26 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.397 0.435 . . . . 0.0 111.583 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.686 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 5.7 pt20 -125.25 67.54 1.13 Allowed 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.695 ' HG2' HD21 ' A' ' 82' ' ' LEU . 16.6 tp10 -77.49 -23.97 50.21 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 165.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 72.0 m 75.12 121.44 0.04 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.233 -174.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.478 HG21 ' C ' ' A' ' 30' ' ' THR . 78.2 t -75.2 -40.15 43.49 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-O 121.203 0.525 . . . . 0.0 110.383 -172.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.421 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 87.9 t80 -73.41 -32.73 64.6 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.576 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 12.9 mt-30 -69.82 -33.49 72.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.969 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.39 -43.7 66.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.245 0.545 . . . . 0.0 110.067 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -62.24 -29.44 70.4 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.506 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.8 p -81.02 -4.91 56.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.852 0.358 . . . . 0.0 111.277 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 32.7 mmtp -85.15 -24.18 28.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.435 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.0 m0 -61.74 148.02 44.29 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.41 -169.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -127.47 19.74 6.78 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.238 -1.347 . . . . 0.0 108.818 176.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -161.07 169.93 36.78 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.59 98.8 11.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 118.047 0.923 . . . . 0.0 111.137 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.63 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -110.65 -152.1 12.89 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 119.965 -1.112 . . . . 0.0 112.109 -177.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.522 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.9 mptp? -153.81 155.03 35.06 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.752 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 94.3 m-85 -85.19 126.73 33.89 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.937 -0.705 . . . . 0.0 109.147 171.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.687 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -103.2 124.35 57.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 O-C-N 121.771 -0.581 . . . . 0.0 110.633 -175.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.554 HD13 HD12 ' A' ' 35' ' ' ILE . 8.4 tp -81.84 105.5 13.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.514 ' HD2' HG22 ' A' ' 109' ' ' VAL . 18.5 ttmm -126.09 171.37 10.89 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.5 mp -92.58 162.3 14.24 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.586 ' HB3' HG23 ' A' ' 58' ' ' VAL . 13.7 ptmm? -91.03 -7.99 50.34 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.925 0.869 . . . . 0.0 109.617 174.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -83.96 -15.23 48.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.205 168.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -102.82 -38.2 7.53 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 1.02 HG13 HG13 ' A' ' 81' ' ' VAL . 76.1 t -88.77 78.09 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.875 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.203 166.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 1.2 mm-40 -123.11 -168.83 1.83 Allowed 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.032 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.29 80.44 1.84 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 170.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.4 m -61.38 91.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.984 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.43 ' HA ' ' HD3' ' A' ' 113' ' ' ARG . 17.0 mmt180 -91.22 97.19 10.98 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 168.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 113' ' ' ARG . 39.6 mt-10 75.5 -42.85 0.48 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.324 1.015 . . . . 0.0 110.798 -174.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -169.43 167.32 10.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm . . . . . 0 N--CA 1.468 0.449 0 O-C-N 123.314 0.384 . . . . 0.0 111.438 178.311 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 120.937 0.399 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -142.91 -164.9 1.94 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.536 -177.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -113.54 7.65 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.242 0.544 . . . . 0.0 109.663 175.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -88.41 1.2 55.22 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.162 174.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -104.23 110.61 22.89 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.789 -174.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p -150.91 139.97 21.08 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.891 178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.917 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.0 p90 -136.53 153.18 51.08 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -89.05 130.29 35.53 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.331 -175.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.532 HG21 ' CE2' ' A' ' 7' ' ' PHE . 3.3 t -114.5 131.58 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.314 178.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.661 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 80.4 mt-30 -100.68 108.08 19.85 Favored 'General case' 0 N--CA 1.428 -1.557 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 162.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.736 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.06 113.98 40.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.581 ' HB2' HG13 ' A' ' 102' ' ' ILE . 83.2 m-70 -68.07 144.88 54.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.168 -177.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -120.3 165.94 14.18 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.3 t -79.35 -25.01 12.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.973 0.416 . . . . 0.0 110.429 -178.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 46' ' ' TYR . 2.6 m -78.3 161.84 68.75 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.309 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 17' ' ' GLU . 5.8 Cg_exo -79.41 -141.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.109 2.539 . . . . 0.0 112.239 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.428 ' H ' ' HB2' ' A' ' 16' ' ' PRO . 10.7 tp10 71.38 -67.85 0.24 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.22 0.608 . . . . 0.0 109.432 -173.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -151.09 105.4 2.99 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 174.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -59.5 -21.06 60.06 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.04 2.493 . . . . 0.0 112.799 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.549 HD12 ' HB3' ' A' ' 10' ' ' GLN . 54.3 tp -108.87 106.24 16.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.255 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.554 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 99.6 m -82.14 109.49 16.5 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.703 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.4 t -93.09 111.51 24.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.483 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.5 pt -124.13 175.9 6.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.053 0.454 . . . . 0.0 111.209 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.0 tttt -124.0 110.56 14.93 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.405 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -110.42 169.43 6.36 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.635 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.968 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.2 Cg_endo -74.36 142.52 30.16 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 121.608 1.539 . . . . 0.0 111.382 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.917 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.1 mtt180 -64.53 -1.44 1.79 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.175 0.512 . . . . 0.0 111.279 -175.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 m -112.88 -6.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.95 175.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.968 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.9 p -50.0 139.84 13.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.509 0.671 . . . . 0.0 111.717 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.584 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 4.2 t -118.33 174.05 6.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.328 174.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.555 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.7 -52.02 44.13 Favored 'General case' 0 C--O 1.213 -0.838 0 O-C-N 123.707 0.629 . . . . 0.0 111.183 -171.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.733 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -55.96 -33.81 65.11 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.564 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -76.07 -52.54 9.95 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.844 0.83 . . . . 0.0 110.46 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.585 ' CG1' HD23 ' A' ' 59' ' ' LEU . 6.0 p -64.43 -27.28 42.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 114.188 -1.369 . . . . 0.0 110.145 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.556 ' O ' HD12 ' A' ' 39' ' ' LEU . 6.4 mm -56.46 -57.59 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.732 171.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.473 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 4.0 tp-100 -66.97 -34.33 77.52 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.948 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -58.87 -43.02 90.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 120.542 0.211 . . . . 0.0 110.855 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.463 HG23 HD21 ' A' ' 103' ' ' LEU . 15.6 m -68.3 -34.69 76.6 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 35' ' ' ILE . 8.1 mp -54.6 -54.48 40.81 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.234 0.54 . . . . 0.0 110.472 172.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 52.2 t -64.63 -34.99 79.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.875 179.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.31 -37.35 87.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.221 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.84 ' HB2' ' HB2' ' A' ' 46' ' ' TYR . . . -106.18 15.45 26.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -171.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.529 ' C ' ' H ' ' A' ' 45' ' ' SER . 24.4 pttm -58.73 107.48 0.52 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.875 0.369 . . . . 0.0 110.587 177.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.873 ' HA ' HD22 ' A' ' 49' ' ' LEU . 97.3 m-85 69.52 -33.55 0.26 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.711 0.805 . . . . 0.0 111.319 -176.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' ' 43' ' ' LYS . 22.9 m -50.07 -64.23 0.87 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.827 0.851 . . . . 0.0 111.32 178.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.84 ' HB2' ' HB2' ' A' ' 42' ' ' ALA . 3.5 m-30 -96.15 19.19 12.15 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.414 ' C ' HD23 ' A' ' 49' ' ' LEU . 31.4 p 48.16 38.77 10.5 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.846 -172.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.469 ' O ' HD12 ' A' ' 49' ' ' LEU . 42.3 mm -84.96 76.07 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.61 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.873 HD22 ' HA ' ' A' ' 44' ' ' TYR . 1.9 mm? -122.87 -15.14 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.882 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -60.33 -43.67 96.21 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.751 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -121.1 92.63 48.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.142 172.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -81.72 -0.23 10.27 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.632 2.221 . . . . 0.0 110.926 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -97.98 125.66 43.24 Favored Pre-proline 0 N--CA 1.449 -0.496 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.654 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.733 ' HB2' HE22 ' A' ' 32' ' ' GLN . 94.0 Cg_endo -81.15 3.92 7.41 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.807 2.338 . . . . 0.0 112.324 -176.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 p -84.21 -26.84 28.43 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.798 -177.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 1.1 m-20 -89.9 4.93 48.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.147 0.499 . . . . 0.0 111.051 -173.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.576 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 38.3 m-85 -111.51 160.84 16.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.185 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.515 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -140.44 137.05 36.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.914 168.049 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.617 HD22 ' HB3' ' A' ' 101' ' ' PHE . 22.4 tp -89.94 140.51 29.55 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.205 0.526 . . . . 0.0 110.561 -177.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.549 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.6 mm? -101.67 128.89 47.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.731 178.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 14.3 pt-20 -92.18 84.25 5.21 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.353 1.073 . . . . 0.0 108.302 170.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 20.1 tt0 -86.08 121.86 29.29 Favored 'General case' 0 N--CA 1.425 -1.719 0 O-C-N 120.902 -1.124 . . . . 0.0 109.506 176.536 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.54 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.4 OUTLIER -104.37 104.47 16.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.358 174.059 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.607 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 61.3 t -63.93 106.66 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.808 179.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HG2' HG23 ' A' ' 63' ' ' VAL . 23.4 mmmt -104.02 92.15 4.26 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.808 -178.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -78.76 137.18 37.63 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.989 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.7 t -156.21 147.66 22.61 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.125 0.488 . . . . 0.0 110.342 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.514 ' HA ' ' HB ' ' A' ' 73' ' ' THR . 46.0 m -149.1 -59.41 0.22 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 32.0 m-20 57.4 -85.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.321 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -86.45 -62.94 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.065 -169.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -125.07 161.52 26.6 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -176.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.7 m -50.54 109.03 0.27 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.37 0.605 . . . . 0.0 111.687 -178.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.514 ' HB ' ' HA ' ' A' ' 68' ' ' THR . 34.4 m -131.03 138.25 49.54 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.432 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 39.8 p -76.97 140.38 66.65 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-O 120.732 0.301 . . . . 0.0 111.429 -176.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -61.58 148.06 93.91 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 123.193 2.596 . . . . 0.0 111.608 176.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -129.44 176.17 8.18 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.874 -171.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 83.7 p -141.44 119.99 12.44 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.523 ' HB3' HG11 ' A' ' 63' ' ' VAL . 22.7 t -91.0 102.64 15.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.584 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -95.14 131.35 41.25 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.075 0.464 . . . . 0.0 110.226 -175.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.563 ' HD3' ' OE2' ' A' ' 61' ' ' GLU . 32.7 ttt-85 -127.0 151.9 47.96 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 1.073 HG13 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.17 140.14 27.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 118.851 0.75 . . . . 0.0 110.448 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.531 HD13 ' HB3' ' A' ' 59' ' ' LEU . 10.0 mt -93.69 165.5 12.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.551 0.691 . . . . 0.0 111.589 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.0 mp -96.12 -174.38 3.08 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.652 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -53.29 -51.11 63.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.275 0.559 . . . . 0.0 110.798 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.584 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 12.9 pt20 -125.84 55.54 1.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.0 tp10 -73.46 -23.03 60.03 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.668 ' HB2' HE21 ' A' ' 90' ' ' GLN . 7.5 m 76.0 132.15 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.013 -176.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.482 ' H ' ' HA ' ' A' ' 30' ' ' THR . 69.5 t -76.04 -42.81 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-O 121.176 0.512 . . . . 0.0 110.155 -174.584 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -73.0 -33.49 65.81 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.668 HE21 ' HB2' ' A' ' 87' ' ' CYS . 15.8 mt-30 -67.55 -36.79 81.65 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.157 173.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -45.35 70.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.557 0.694 . . . . 0.0 110.344 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.479 HE22 ' HE2' ' A' ' 7' ' ' PHE . 4.8 tt0 -61.7 -32.57 72.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.816 -177.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.5 p -76.24 -16.11 59.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.648 0.261 . . . . 0.0 111.432 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 24.5 mmtp -74.67 -27.31 60.36 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.365 0.603 . . . . 0.0 110.016 176.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -55.68 144.67 26.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.765 -1.107 . . . . 0.0 113.695 -169.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -108.04 14.74 24.93 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.222 -1.354 . . . . 0.0 109.255 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.36 -166.59 30.38 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.607 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -107.46 107.97 19.08 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 117.54 0.67 . . . . 0.0 110.999 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.566 ' HA3' HG21 ' A' ' 64' ' ' VAL . . . -116.68 -147.47 8.73 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.575 -0.822 . . . . 0.0 111.777 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.661 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -152.05 160.46 43.44 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 173.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.736 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 85.9 m-85 -88.87 123.91 33.69 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 169.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.581 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.8 mp -103.07 121.97 54.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 121.952 -0.468 . . . . 0.0 110.188 -175.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.543 ' CD1' HD11 ' A' ' 35' ' ' ILE . 7.8 tp -79.31 112.07 16.18 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.623 ' HD2' HG21 ' A' ' 109' ' ' VAL . 17.7 ttmm -131.39 168.88 16.83 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.576 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 2.1 mp -91.53 161.17 15.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 14.3 ptmm? -88.27 -11.47 46.43 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 121.762 0.792 . . . . 0.0 109.486 174.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -79.01 -10.61 59.88 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.509 167.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -107.55 -39.22 5.68 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 1.073 HG12 HG13 ' A' ' 81' ' ' VAL . 56.6 t -99.14 91.53 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.528 169.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 1.1 tm0? -131.61 -79.0 0.52 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.517 1.151 . . . . 0.0 110.197 -177.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -168.88 63.17 0.06 Allowed 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 112.703 -2.044 . . . . 0.0 107.457 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 116' ' ' LYS . 9.4 m -54.02 103.76 0.09 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.125 -1.398 . . . . 0.0 112.136 -174.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 114' ' ' GLU . 23.0 mmt180 -89.7 95.13 10.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 175.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 113' ' ' ARG . 41.2 mt-10 71.56 -57.32 0.61 Allowed 'General case' 0 N--CA 1.466 0.369 0 O-C-N 124.088 0.867 . . . . 0.0 110.412 -171.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -164.92 143.93 6.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.561 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.493 ' O ' ' HA ' ' A' ' 112' ' ' SER . 47.3 mmtm . . . . . 0 N--CA 1.467 0.396 0 O-C-N 123.581 0.551 . . . . 0.0 111.085 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.528 ' HB3' ' HG2' ' A' ' 5' ' ' GLU . 32.8 t -83.8 169.87 14.74 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.6 -16.26 17.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -99.06 13.49 32.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.207 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.528 ' HG2' ' HB3' ' A' ' 2' ' ' SER . 4.0 pt-20 -103.89 109.57 21.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.461 0.648 . . . . 0.0 111.063 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.413 ' HB2' ' HE2' ' A' ' 24' ' ' LYS . 17.4 m -156.48 131.39 9.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.938 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.881 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.0 p90 -114.4 157.31 23.04 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -87.95 133.73 33.87 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.002 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.517 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -118.69 129.56 74.76 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.442 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.573 ' HB3' HD12 ' A' ' 20' ' ' LEU . 79.7 mt-30 -96.97 108.03 20.67 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 163.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.706 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.88 118.95 56.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.33 0.586 . . . . 0.0 110.499 178.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.558 ' HB2' HG13 ' A' ' 102' ' ' ILE . 29.1 m-70 -76.13 140.38 41.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.935 -177.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -105.71 167.38 9.81 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 171.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.61 -13.44 8.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.315 0.579 . . . . 0.0 110.542 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.792 ' HB2' ' HB3' ' A' ' 46' ' ' TYR . 6.0 m -98.7 156.78 35.24 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.589 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_endo -86.09 139.84 6.42 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.997 2.464 . . . . 0.0 112.715 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 164.45 -64.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.599 -1.63 . . . . 0.0 106.599 -177.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.9 tp60 -151.62 84.73 5.02 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 168.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -46.02 -40.77 20.89 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.666 2.91 . . . . 0.0 113.197 -169.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 10' ' ' GLN . 45.0 tp -89.72 103.1 15.78 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 172.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.614 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 50.6 m -83.36 108.05 16.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.419 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 56.5 t -95.65 111.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.517 HG13 ' HB ' ' A' ' 9' ' ' VAL . 12.8 pt -120.69 175.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.0 111.323 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.413 ' HE2' ' HB2' ' A' ' 6' ' ' SER . 39.8 tttt -122.87 120.15 32.64 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 170.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.417 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -126.74 167.88 16.15 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -171.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.907 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.2 Cg_exo -68.2 139.59 46.63 Favored 'Trans proline' 0 N--CA 1.442 -1.52 0 C-N-CA 121.293 1.329 . . . . 0.0 111.429 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.881 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 42.3 mtt180 -66.72 -0.86 3.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.233 0.539 . . . . 0.0 110.701 -177.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.2 m -112.26 -9.1 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.979 174.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.907 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.5 p -46.45 139.59 4.85 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.891 0.853 . . . . 0.0 112.724 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.512 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 4.3 t -116.35 174.74 5.89 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.264 172.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.19 -50.79 48.28 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 123.579 0.55 . . . . 0.0 111.576 -171.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.683 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -57.94 -34.63 70.1 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.43 -177.805 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.33 -52.38 16.45 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.043 0.925 . . . . 0.0 110.084 -176.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.865 HG12 HD21 ' A' ' 59' ' ' LEU . 8.0 p -65.09 -27.94 43.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.261 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.693 HG12 ' O ' ' A' ' 31' ' ' ALA . 7.2 mm -56.77 -58.97 3.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.378 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.45 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 10.2 tt0 -73.77 -32.49 63.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.509 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.7 -42.72 84.31 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 120.781 0.324 . . . . 0.0 110.156 174.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.3 m -66.32 -38.06 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.017 175.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.558 HD12 ' O ' ' A' ' 35' ' ' ILE . 7.8 mp -53.5 -44.25 68.9 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.804 173.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.1 t -63.19 -34.14 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.258 0.551 . . . . 0.0 111.026 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -80.48 -21.58 41.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.216 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.553 ' HA ' ' HD1' ' A' ' 46' ' ' TYR . . . -105.67 -10.12 16.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -172.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.451 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 21.0 pttm -59.33 113.88 2.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.828 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.792 ' HA ' HD23 ' A' ' 49' ' ' LEU . 82.7 m-85 70.71 -43.67 0.56 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.016 0.927 . . . . 0.0 110.964 -176.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.419 ' H ' ' C ' ' A' ' 43' ' ' LYS . 15.3 m -45.54 -60.5 2.15 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 123.949 0.9 . . . . 0.0 111.156 177.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.792 ' HB3' ' HB2' ' A' ' 15' ' ' SER . 19.7 m-85 -102.15 18.58 20.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 177.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.449 ' C ' HD21 ' A' ' 49' ' ' LEU . 38.7 p 48.72 35.6 6.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.667 -172.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.443 ' O ' HD12 ' A' ' 49' ' ' LEU . 41.7 mm -82.93 79.15 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.173 172.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.792 HD23 ' HA ' ' A' ' 44' ' ' TYR . 2.2 mm? -121.78 -13.61 8.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.163 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.2 m -66.68 -46.78 74.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.958 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -122.22 87.11 47.88 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.548 175.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.46 8.25 4.11 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.313 2.675 . . . . 0.0 111.574 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -100.44 127.72 32.16 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.334 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.683 ' HB2' HE22 ' A' ' 32' ' ' GLN . 98.4 Cg_endo -81.23 5.91 5.94 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.888 2.392 . . . . 0.0 113.529 -174.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.48 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 13.2 p -79.19 -35.33 41.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.007 -175.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.513 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 60.5 m-20 -92.55 10.98 28.03 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -173.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 42.2 m-85 -113.09 151.9 30.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.066 0.46 . . . . 0.0 111.1 -175.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.494 HG23 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -138.8 142.92 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.765 170.732 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.865 HD21 HG12 ' A' ' 34' ' ' VAL . 19.6 tp -94.57 142.56 27.31 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.015 0.436 . . . . 0.0 110.014 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.553 ' CD1' HG12 ' A' ' 81' ' ' VAL . 2.1 mm? -106.45 125.06 50.52 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.633 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.638 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -88.62 85.47 6.82 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 122.505 1.145 . . . . 0.0 108.351 171.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.536 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 1.8 tm-20 -87.14 121.73 29.99 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.581 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -109.51 112.4 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.464 176.184 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.625 HG21 ' HA3' ' A' ' 99' ' ' GLY . 61.1 t -65.78 107.42 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.343 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.508 ' HD3' ' HB2' ' A' ' 96' ' ' LYS . 23.4 mmmt -107.64 93.77 4.72 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.566 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.405 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 6.6 p-10 -80.51 140.59 35.8 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 172.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -141.19 41.04 1.78 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.632 -172.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.71 ' HA ' ' HB ' ' A' ' 73' ' ' THR . 31.5 m -59.92 -59.45 5.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 174.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 60.2 -80.61 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.506 173.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -110.46 -36.07 5.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.422 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.569 ' HZ3' ' HB2' ' A' ' 71' ' ' LYS . 4.9 ttmp? -138.17 156.24 47.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -177.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.7 m -50.48 98.9 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.333 0.587 . . . . 0.0 111.358 179.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.71 ' HB ' ' HA ' ' A' ' 68' ' ' THR . 74.3 m -125.11 133.52 52.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.195 -0.911 . . . . 0.0 108.949 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.431 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 39.5 p -71.3 135.08 84.56 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-O 120.899 0.381 . . . . 0.0 111.012 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 31.6 Cg_exo -63.14 161.1 31.48 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.262 2.642 . . . . 0.0 111.997 178.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -136.15 165.76 24.97 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -174.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.1 p -129.86 104.09 7.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.009 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.504 ' HB3' HG11 ' A' ' 63' ' ' VAL . 26.9 t -82.23 100.19 9.73 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.536 ' HG2' HD11 ' A' ' 60' ' ' LEU . 7.3 tt0 -93.47 131.49 38.64 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.582 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 30.7 ttt-85 -126.35 150.44 48.55 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.786 HG13 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.48 144.21 16.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 118.979 0.809 . . . . 0.0 110.328 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.544 HD13 ' HB3' ' A' ' 59' ' ' LEU . 15.7 mt -101.62 149.64 23.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.872 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.416 HD13 ' N ' ' A' ' 83' ' ' LEU . 6.2 mp -83.26 172.31 12.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.599 171.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -48.02 -48.98 32.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.221 0.534 . . . . 0.0 110.983 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.462 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 19.0 pt20 -119.52 38.84 3.76 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.17 -176.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.55 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.1 tp10 -71.01 -21.83 62.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.986 0.422 . . . . 0.0 109.923 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.606 ' HB2' HE21 ' A' ' 90' ' ' GLN . 43.8 m 76.14 125.22 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.962 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.512 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.2 t -76.39 -39.41 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.078 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -72.88 -33.93 66.36 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.606 HE21 ' HB2' ' A' ' 87' ' ' CYS . 14.9 mt-30 -67.11 -30.05 69.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.958 174.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.66 -42.58 50.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.342 0.591 . . . . 0.0 110.397 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -56.78 -37.67 71.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.742 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 71.7 p -72.39 -13.9 61.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.818 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -78.1 -27.73 48.49 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 110.588 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.44 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.1 m0 -55.69 139.24 45.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -166.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.508 ' HB2' ' HD3' ' A' ' 65' ' ' LYS . 88.8 mttt -109.59 14.12 23.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.787 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.84 176.13 45.04 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.747 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.69 99.08 10.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.692 0.746 . . . . 0.0 110.857 -177.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.625 ' HA3' HG21 ' A' ' 64' ' ' VAL . . . -106.97 -148.8 15.32 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.963 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.482 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.7 mptp? -150.15 155.61 40.11 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.711 ' HB3' HD23 ' A' ' 59' ' ' LEU . 99.2 m-85 -84.58 120.78 26.75 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 169.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.558 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -102.07 127.37 55.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.846 -0.534 . . . . 0.0 110.356 -174.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.414 HD13 HD12 ' A' ' 35' ' ' ILE . 8.9 tp -81.19 120.87 25.42 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.715 ' HD2' HG21 ' A' ' 109' ' ' VAL . 19.3 ttmm -140.63 175.64 9.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.2 mp -98.47 156.47 16.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.494 ' HB3' HG23 ' A' ' 58' ' ' VAL . 19.2 ptmt -91.36 -5.91 53.78 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.092 0.949 . . . . 0.0 110.245 178.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -91.25 -3.41 56.93 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.747 166.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -108.72 -40.26 5.12 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 175.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.786 HG12 HG13 ' A' ' 81' ' ' VAL . 51.2 t -86.12 93.6 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.371 166.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.78 -176.14 5.02 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 176.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.28 45.24 0.74 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.408 0.623 . . . . 0.0 109.842 176.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 46.2 m -69.35 118.7 12.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.536 -174.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -75.54 115.82 15.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.598 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 66.44 -70.12 0.11 Allowed 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.93 0.769 . . . . 0.0 110.76 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -164.55 134.51 3.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.611 0.243 . . . . 0.0 110.556 175.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm . . . . . 0 N--CA 1.466 0.354 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.246 -179.231 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.5 m . . . . . 0 N--CA 1.477 0.925 0 CA-C-O 120.815 0.34 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.7 p -159.18 149.31 19.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.386 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -82.16 -28.8 31.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.385 0.612 . . . . 0.0 109.594 175.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -81.23 157.34 25.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.291 177.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.511 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.8 tt0 -123.5 138.77 54.51 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.313 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.1 m -97.88 138.01 35.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.972 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.558 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.3 p90 -104.3 150.0 24.84 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -80.53 120.67 24.81 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.189 -174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' HG13 ' A' ' 23' ' ' ILE . 19.1 t -107.06 135.53 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.424 175.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.548 ' HB3' HD13 ' A' ' 20' ' ' LEU . 56.9 mt-30 -112.69 109.04 18.3 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 165.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.718 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -131.49 122.82 51.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.112 -175.461 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.548 ' CD2' HD12 ' A' ' 20' ' ' LEU . 42.3 m-70 -79.69 145.01 33.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.811 -176.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -123.34 167.79 13.34 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.093 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 31.2 m -79.4 -1.51 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' A' ' 46' ' ' TYR . 38.8 t -81.39 147.32 59.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.118 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.57 -173.16 1.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.173 2.582 . . . . 0.0 110.613 169.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 61.41 77.85 0.31 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -177.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 64.95 72.75 0.46 Allowed Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.616 -172.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.32 -31.07 53.44 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.014 2.476 . . . . 0.0 112.036 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.548 HD13 ' HB3' ' A' ' 10' ' ' GLN . 51.9 tp -81.94 99.91 9.36 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.8 m -75.19 109.51 8.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.278 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -94.73 115.75 34.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.552 HG13 ' HB ' ' A' ' 9' ' ' VAL . 1.6 pt -130.97 130.06 63.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.363 -177.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -84.5 96.05 9.0 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -107.28 162.15 20.69 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.336 -173.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.87 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.6 Cg_exo -65.29 144.76 81.75 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.747 1.631 . . . . 0.0 112.158 -171.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.558 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 18.7 mtp180 -60.22 -11.28 5.9 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.609 0.719 . . . . 0.0 110.214 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.87 -4.41 9.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.46 177.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.87 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.8 p -58.33 124.6 20.05 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.495 0.664 . . . . 0.0 110.777 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.532 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.7 t -106.06 177.88 4.73 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.261 172.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.709 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.63 -50.33 24.72 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 123.564 0.54 . . . . 0.0 111.938 -171.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.63 ' HB2' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -71.44 -27.56 63.35 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.634 -176.385 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.88 -49.34 53.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.895 0.855 . . . . 0.0 109.158 178.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 31' ' ' ALA . 2.3 p -69.18 -27.65 35.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.941 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.709 HG13 ' O ' ' A' ' 31' ' ' ALA . 12.2 mt -56.64 -57.69 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.459 170.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.51 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 36.3 tt0 -66.1 -32.19 73.5 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.866 -176.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -59.44 -45.91 90.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-O 121.373 0.606 . . . . 0.0 109.686 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.4 m -64.82 -39.59 93.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.081 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.2 mp -50.79 -43.79 58.77 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.063 0.459 . . . . 0.0 110.828 173.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 86.0 m -63.46 -43.95 95.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.749 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -79.64 -16.41 55.83 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.92 11.71 34.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.503 0.192 . . . . 0.0 111.089 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.85 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.1 ttmt -58.68 103.61 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.671 -177.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.49 ' HD2' ' HG2' ' A' ' 43' ' ' LYS . 98.1 m-85 59.95 21.12 10.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.538 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.3 m -77.88 -81.76 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.223 0.535 . . . . 0.0 109.894 174.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.477 ' HB2' ' HB2' ' A' ' 15' ' ' SER . 37.4 t80 -95.27 6.9 47.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.417 -0.956 . . . . 0.0 108.417 174.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.1 t 62.34 65.23 0.88 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.45 -176.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.476 ' O ' HG23 ' A' ' 48' ' ' ILE . 48.8 mm -90.37 12.55 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.98 1.371 . . . . 0.0 108.222 173.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.85 HD23 ' HA ' ' A' ' 43' ' ' LYS . 1.5 mm? -91.9 10.19 29.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.334 -170.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.2 m -71.66 -28.58 63.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.074 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.414 ' HB2' ' CE1' ' A' ' 57' ' ' TYR . 18.7 m120 -131.34 91.58 34.72 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.42 5.62 4.56 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.217 1.945 . . . . 0.0 112.717 -176.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.419 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.5 p-10 -108.94 132.3 21.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.63 ' HB2' ' HB2' ' A' ' 32' ' ' GLN . 3.4 Cg_exo -76.21 18.35 0.67 Allowed 'Trans proline' 0 CA--C 1.528 0.189 0 C-N-CA 123.167 2.578 . . . . 0.0 112.493 -178.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.405 ' H ' ' C ' ' A' ' 53' ' ' ASN . 6.6 m -90.21 -38.31 13.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.343 -173.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.0 m-20 -88.48 2.77 52.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.95 -176.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 16.4 m-85 -104.54 175.32 5.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.352 0.596 . . . . 0.0 110.189 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.568 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -144.28 180.0 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.339 169.838 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 1.023 HD12 ' HB3' ' A' ' 101' ' ' PHE . 1.7 tm? -144.19 137.51 27.45 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 -176.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.611 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.49 127.33 46.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.82 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.2 pt-20 -93.21 84.24 4.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.476 1.132 . . . . 0.0 108.549 169.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.618 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 7.3 tt0 -86.0 123.35 31.23 Favored 'General case' 0 N--CA 1.426 -1.659 0 O-C-N 121.624 -0.672 . . . . 0.0 109.956 176.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.524 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -113.77 116.13 51.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.086 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.629 HG22 ' HA3' ' A' ' 99' ' ' GLY . 97.4 t -70.9 106.98 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.29 0.567 . . . . 0.0 110.601 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.505 ' HG2' HG21 ' A' ' 63' ' ' VAL . 23.6 mmmt -118.15 91.25 3.52 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.342 177.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.62 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 7.8 p-10 -58.5 172.87 0.44 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.729 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.8 t -95.38 103.79 15.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.171 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.8 m -65.52 -36.51 84.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.496 0.665 . . . . 0.0 109.9 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -97.17 -137.56 0.27 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -128.29 90.09 3.02 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.266 0.555 . . . . 0.0 112.073 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -102.71 -32.65 9.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.714 169.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -137.61 153.98 49.82 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.272 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 10.0 t -66.61 -29.12 69.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.133 0.492 . . . . 0.0 110.325 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.0 p -119.25 161.79 35.19 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.084 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -54.06 151.34 28.01 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.438 2.092 . . . . 0.0 111.929 172.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.62 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 22.4 pttp -120.46 151.83 38.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.152 0.501 . . . . 0.0 111.775 -169.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.515 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 50.4 m -114.87 124.45 51.76 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.771 -177.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.9 t -87.27 98.66 11.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 7.6 tt0 -97.7 131.67 44.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.726 -174.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.522 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 2.3 tmt_? -128.04 148.7 50.56 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.7 HG13 HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.63 133.77 51.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 118.665 0.666 . . . . 0.0 111.005 -177.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.648 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 9.3 mt -93.14 166.61 12.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.394 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.439 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.7 mp -95.49 -176.8 3.88 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 165.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -59.67 -32.61 70.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.532 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 6.3 pt20 -125.28 38.58 4.15 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -176.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.648 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 13.3 mm-40 -75.38 -12.7 60.31 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.019 171.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.618 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 63.6 m 68.95 121.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.445 0.64 . . . . 0.0 111.943 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.511 ' H ' ' HA ' ' A' ' 30' ' ' THR . 74.9 t -75.75 -39.79 39.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.183 -173.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -72.58 -38.22 67.94 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.618 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 12.1 mt-30 -58.27 -46.77 85.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.51 172.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.18 -46.84 87.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.729 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -60.56 -26.98 67.32 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.181 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 t -75.12 -20.71 59.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -77.13 -23.12 51.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.361 0.6 . . . . 0.0 110.311 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.404 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.7 m0 -60.47 133.37 56.03 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.427 -172.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -113.16 11.85 18.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.695 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -156.77 167.78 33.73 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 109.081 -1.608 . . . . 0.0 109.081 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.77 105.65 17.94 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 118.02 0.91 . . . . 0.0 110.702 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.629 ' HA3' HG22 ' A' ' 64' ' ' VAL . . . -110.52 -142.84 9.4 Favored Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.586 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.473 ' HG3' ' C ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -158.1 160.32 37.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.104 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 1.023 ' HB3' HD12 ' A' ' 59' ' ' LEU . 95.8 m-85 -89.35 151.87 21.83 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 169.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.611 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.9 mp -132.69 128.89 58.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 O-C-N 121.933 -0.479 . . . . 0.0 110.465 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.428 HD13 HG12 ' A' ' 35' ' ' ILE . 12.8 tp -84.1 136.8 33.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.536 ' HD2' HG21 ' A' ' 109' ' ' VAL . 22.1 ttmm -154.27 165.31 36.72 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.553 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -89.04 149.78 23.07 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 169.71 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.568 ' CA ' HG23 ' A' ' 58' ' ' VAL . 13.2 ptmm? -78.17 -28.62 48.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.172 0.51 . . . . 0.0 109.947 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.29 -13.89 61.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.479 0.657 . . . . 0.0 109.731 172.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -100.17 -9.38 22.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.7 HG22 HG13 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -96.85 -16.74 7.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.674 -178.767 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.428 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 4.0 pt20 -58.33 88.03 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 122.256 1.027 . . . . 0.0 112.114 -171.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -118.74 1.17 11.57 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.737 175.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.1 t -139.1 99.74 3.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.887 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 24.4 mmt85 66.75 -176.22 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.976 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -75.57 138.13 41.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.448 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -73.73 -31.72 63.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 -177.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 20.0 pttm . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.004 -178.934 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 120.999 0.428 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -89.84 26.17 1.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 47.08 58.62 4.64 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.339 -167.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -21.64 109.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 O-C-N 125.364 1.665 . . . . 0.0 112.933 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -103.68 132.11 50.24 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.056 -173.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 p -111.69 169.61 8.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.033 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.1 p90 -130.2 149.8 51.74 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -89.42 138.31 31.56 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.858 -177.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.446 HG21 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -126.49 158.09 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.092 0.472 . . . . 0.0 109.888 176.265 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.52 ' HB2' HD13 ' A' ' 20' ' ' LEU . 5.2 pm0 -129.63 107.46 9.46 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 163.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.53 HG11 ' HB2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -118.36 139.63 44.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.727 -174.692 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 -81.93 118.61 23.09 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.031 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -82.64 167.44 18.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.091 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.2 t -62.75 -36.58 76.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.104 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 p -71.2 122.53 87.29 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 111.308 -176.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.03 -170.05 0.85 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.415 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 73.16 -38.92 0.43 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.99 0.916 . . . . 0.0 111.236 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.458 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 5.9 tp60 -116.9 83.44 14.53 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 165.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -65.0 -53.16 0.93 Allowed 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 123.023 2.482 . . . . 0.0 112.673 -170.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 10' ' ' GLN . 40.4 tp -90.89 116.97 29.12 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.054 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.8 m -95.96 106.85 19.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.768 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.8 t -85.08 120.64 35.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.2 pt -130.92 168.73 23.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.891 0.377 . . . . 0.0 110.783 -177.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -124.87 111.93 16.05 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -117.92 164.73 18.53 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.002 -175.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.688 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 5.8 Cg_exo -68.23 143.91 60.67 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 122.203 1.936 . . . . 0.0 111.993 -179.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 44.7 mtp180 -64.81 -3.64 3.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.532 0.682 . . . . 0.0 110.449 -176.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.406 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.8 m -109.43 -7.9 11.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.109 177.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.688 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 0.8 OUTLIER -55.62 123.18 13.22 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 121.484 0.659 . . . . 0.0 111.875 174.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.652 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.2 t -100.47 178.91 4.6 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.96 170.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.507 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.34 -51.4 19.59 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.607 0.567 . . . . 0.0 111.238 -172.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.488 HE21 ' CA ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -61.89 -32.05 72.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -177.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.64 -52.19 16.41 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.787 0.803 . . . . 0.0 109.368 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.406 ' CG1' HD21 ' A' ' 59' ' ' LEU . 2.3 p -66.91 -29.29 45.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.064 -178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.849 HD12 ' HG ' ' A' ' 103' ' ' LEU . 5.7 mm -56.93 -58.39 5.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.086 172.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.434 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.2 tt0 -68.51 -32.04 71.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.699 -175.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.5 ' O ' ' HG2' ' A' ' 41' ' ' LYS . 6.3 tp60 -63.8 -37.4 87.25 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 120.985 0.422 . . . . 0.0 109.976 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 27.7 m -70.53 -36.03 73.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.88 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.9 mp -55.45 -36.57 66.7 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.445 0.641 . . . . 0.0 110.375 172.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.9 m -70.45 -38.58 74.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.105 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 75.1 mmtt -71.02 -28.09 64.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.788 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 6.74 47.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.557 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.465 ' HG2' HD12 ' A' ' 49' ' ' LEU . 6.0 tmmm? -59.95 121.57 12.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.915 ' HA ' HD23 ' A' ' 49' ' ' LEU . 1.7 t80 78.29 -31.45 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.183 0.993 . . . . 0.0 110.99 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -63.41 117.32 6.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 176.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.7 t80 65.39 8.69 5.16 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.684 0.754 . . . . 0.0 109.671 -177.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.434 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 13.4 p 43.14 75.46 0.09 Allowed 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.421 -172.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.8 tt -85.8 7.78 2.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.686 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.915 HD23 ' HA ' ' A' ' 44' ' ' TYR . 1.1 mm? -70.91 -10.56 59.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.741 -171.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 m -70.23 -20.87 63.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 109.969 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -139.57 69.73 38.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.974 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -91.54 11.25 2.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.476 2.784 . . . . 0.0 112.618 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.3 OUTLIER -98.66 126.17 39.96 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.39 177.614 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.47 ' HB2' HE22 ' A' ' 32' ' ' GLN . 89.6 Cg_endo -93.51 2.04 3.32 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.052 2.502 . . . . 0.0 114.149 -173.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.9 t -71.39 -33.81 69.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.608 0.242 . . . . 0.0 111.328 -174.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.635 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.2 OUTLIER -82.6 7.02 15.79 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 0.0 111.565 -178.482 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.519 ' HB3' HD11 ' A' ' 35' ' ' ILE . 6.7 m-85 -106.77 137.9 43.94 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.227 -176.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.62 HG21 ' O ' ' A' ' 104' ' ' LYS . 0.8 OUTLIER -118.83 165.71 13.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 165.827 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 101' ' ' PHE . 13.9 tp -117.89 138.46 52.11 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.526 HD12 ' HA ' ' A' ' 81' ' ' VAL . 2.6 mm? -98.51 126.08 43.95 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.693 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.1 pt-20 -88.66 86.43 6.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.584 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 10.8 tt0 -86.98 121.93 30.12 Favored 'General case' 0 N--CA 1.423 -1.817 0 O-C-N 120.702 -1.249 . . . . 0.0 108.733 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.493 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.4 OUTLIER -106.03 115.84 48.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 CA-C-O 121.425 0.631 . . . . 0.0 109.366 174.742 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.711 HG22 ' HA3' ' A' ' 99' ' ' GLY . 53.4 t -85.49 98.41 6.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.217 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.47 ' HB2' ' HZ3' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -81.9 65.95 7.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.519 1.152 . . . . 0.0 108.644 174.142 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -75.72 146.76 39.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.955 -175.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.9 t -68.74 131.76 45.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.418 0.628 . . . . 0.0 111.403 -176.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 m -100.6 -4.12 29.14 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.513 0.673 . . . . 0.0 109.543 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -96.54 -173.75 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.527 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -146.54 78.66 1.51 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.227 0.537 . . . . 0.0 111.456 177.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -172.88 -51.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.48 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.1 t -148.25 174.64 11.79 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.645 -178.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m 71.26 107.08 0.06 Allowed 'General case' 0 C--N 1.333 -0.13 0 O-C-N 123.708 0.63 . . . . 0.0 110.529 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.9 p -84.46 160.11 57.33 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.739 -178.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.05 125.91 18.86 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.332 2.021 . . . . 0.0 111.496 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -118.9 144.08 46.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.929 -175.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 12.7 p -119.76 121.06 38.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.674 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.475 ' HB2' HG11 ' A' ' 63' ' ' VAL . 20.3 m -104.27 103.06 12.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 16.2 tt0 -95.77 130.78 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -175.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -132.06 131.38 42.37 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.526 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -88.92 137.18 21.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.446 -173.885 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 17.9 mt -97.37 159.96 14.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.707 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.595 ' H ' ' HG3' ' A' ' 86' ' ' GLU . 7.7 mp -86.92 -169.63 2.71 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 165.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.11 -36.12 82.31 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.695 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.652 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 3.4 pt20 -125.11 44.6 2.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.595 ' HG3' ' H ' ' A' ' 83' ' ' LEU . 8.1 mm-40 -77.33 -9.66 58.97 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 122.174 -0.329 . . . . 0.0 110.875 172.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.649 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 16.7 t 74.41 129.32 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.088 0.955 . . . . 0.0 111.415 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.542 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.6 t -78.54 -46.85 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 109.778 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -72.41 -41.4 66.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.505 -174.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.649 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 8.7 mm-40 -63.26 -45.0 93.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.658 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.99 -51.26 69.95 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 110.493 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -55.49 -36.51 66.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.125 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.5 t -72.25 -15.73 61.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.454 -177.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 68.4 mmtt -90.9 -13.01 34.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.329 0.585 . . . . 0.0 110.737 -178.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 42.1 m0 -59.01 152.35 20.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.177 -174.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.452 ' H ' HG22 ' A' ' 63' ' ' VAL . 3.3 mppt? -109.05 15.79 23.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.422 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -179.91 176.38 47.41 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 114.618 -1.174 . . . . 0.0 110.603 -176.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.483 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -94.38 106.63 18.61 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.512 0.656 . . . . 0.0 110.925 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.711 ' HA3' HG22 ' A' ' 64' ' ' VAL . . . -106.89 -146.76 13.48 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.073 -177.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -149.39 137.66 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.53 ' HB2' HG11 ' A' ' 11' ' ' VAL . 98.0 m-85 -84.34 146.31 27.78 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.521 -0.872 . . . . 0.0 109.324 169.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.521 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 71.3 mt -135.61 129.61 49.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 O-C-N 122.079 -0.388 . . . . 0.0 111.587 -171.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.849 ' HG ' HD12 ' A' ' 35' ' ' ILE . 9.1 mp -79.61 107.93 12.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 110.009 174.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.62 ' O ' HG21 ' A' ' 58' ' ' VAL . 32.2 ttpt -138.26 128.86 26.45 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.562 HD21 ' O ' ' A' ' 56' ' ' ASP . 19.3 mt -62.32 139.72 58.52 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.624 0.726 . . . . 0.0 112.895 -171.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.9 ptmm? -70.95 -30.02 66.21 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.481 179.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.442 ' OE1' ' HG3' ' A' ' 106' ' ' LYS . 7.4 mm-40 -69.99 -14.8 62.87 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -111.24 -21.67 11.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.542 175.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.52 HG21 ' HG2' ' A' ' 104' ' ' LYS . 1.1 t -79.08 -27.32 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.317 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 8.4 mm-40 -52.3 91.24 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.812 0.815 . . . . 0.0 112.872 -173.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -139.66 11.99 2.5 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.179 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.5 m -67.26 105.4 1.73 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.339 -1.301 . . . . 0.0 111.079 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 113' ' ' ARG . 17.8 mtp180 -128.72 -48.15 1.26 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.578 176.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.9 -65.02 1.02 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.046 -177.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -90.65 132.53 35.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.424 0.63 . . . . 0.0 110.063 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.759 -175.816 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.03 0.443 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 p 179.37 -160.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.53 -33.34 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -72.7 125.76 28.27 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.838 173.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.474 ' OE2' ' HD2' ' A' ' 27' ' ' ARG . 29.3 tt0 -104.82 141.12 37.07 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.21 -170.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.49 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m -91.01 133.33 35.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 168.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.794 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.545 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.534 ' HB3' HD12 ' A' ' 20' ' ' LEU . 45.8 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.791 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.63 ' HE2' ' HD3' ' A' ' 100' ' ' LYS . 78.2 m-70 -77.26 143.52 38.85 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -135.48 170.22 16.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.483 ' CG2' HD13 ' A' ' 48' ' ' ILE . 10.4 m -86.24 -1.08 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-O 120.632 0.253 . . . . 0.0 111.584 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -62.48 128.89 92.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.984 0.421 . . . . 0.0 110.295 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.7 170.48 19.92 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.024 2.483 . . . . 0.0 113.011 -176.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 18' ' ' GLN . 11.8 tp10 61.43 94.2 0.04 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.927 -175.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.448 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 13.2 mm-40 66.33 76.52 0.29 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.146 -170.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.21 -32.1 93.96 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.677 2.251 . . . . 0.0 111.195 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.534 HD12 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp -80.8 106.45 12.81 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.618 174.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.486 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.545 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.858 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.794 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' A' ' 26' ' ' PRO . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.858 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.547 ' HG1' ' HA ' ' A' ' 85' ' ' GLN . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.674 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.589 ' HA ' HD13 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.456 ' CG1' HG22 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.674 HG13 ' O ' ' A' ' 31' ' ' ALA . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.532 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.532 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -116.07 16.77 16.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.842 ' HA ' HD22 ' A' ' 49' ' ' LEU . 36.2 ttmt -62.45 110.15 1.58 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.237 -176.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.488 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 32.8 m-85 70.7 -12.32 0.56 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.579 1.152 . . . . 0.0 112.142 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 43' ' ' LYS . 15.4 m -54.72 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -99.05 6.78 46.45 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.464 ' C ' ' H ' ' A' ' 49' ' ' LEU . 30.3 t 57.45 42.72 24.16 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.275 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.483 HD13 ' CG2' ' A' ' 14' ' ' VAL . 22.5 mm -63.52 -9.6 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.832 171.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.842 HD22 ' HA ' ' A' ' 43' ' ' LYS . 1.3 mm? -73.24 9.51 1.25 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.102 -1.408 . . . . 0.0 111.557 -171.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -59.94 -32.41 70.77 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 173.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -120.55 86.01 39.0 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.78 7.05 3.34 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.275 1.983 . . . . 0.0 113.012 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.426 HD21 ' HB2' ' A' ' 55' ' ' SER . 5.7 p-10 -113.77 136.84 22.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.929 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.425 ' HB3' ' HB2' ' A' ' 36' ' ' GLN . 65.6 Cg_endo -75.61 7.51 3.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.122 2.548 . . . . 0.0 112.869 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.437 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 4.2 m -88.23 -13.2 41.62 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.864 -174.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 37.2 m-20 -109.94 15.02 22.87 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 -176.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.556 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.581 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 1.016 HD12 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.712 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.641 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.535 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.534 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t -67.72 112.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HB3' ' HE3' ' A' ' 65' ' ' LYS . 24.7 mmmt -123.12 95.13 4.49 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.788 -1.096 . . . . 0.0 108.973 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.552 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 6.8 p-10 -60.77 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.402 -175.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.8 t -122.93 114.32 20.28 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.389 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 m -69.61 -36.62 76.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.212 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -87.02 -152.37 0.19 Allowed 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' HB3' ' HE2' ' A' ' 70' ' ' LYS . 48.3 mtpt -113.81 81.51 1.54 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.199 0.523 . . . . 0.0 110.975 173.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -104.76 -31.57 9.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.602 173.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.437 HG23 ' H ' ' A' ' 74' ' ' THR . 14.5 m -139.33 143.87 38.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.386 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -64.61 -19.73 65.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.0 111.215 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.437 ' H ' HG23 ' A' ' 72' ' ' THR . 7.3 p -137.8 160.42 64.84 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.859 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.7 133.61 45.03 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.277 1.985 . . . . 0.0 111.598 172.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.552 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 21.3 pttp -112.87 164.92 12.82 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.61 -168.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m -113.63 139.98 48.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.008 -177.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.599 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.501 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.633 HG13 HG23 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.635 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.49 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.547 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.623 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.53 HG13 ' HZ ' ' A' ' 7' ' ' PHE . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.623 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 0.9 OUTLIER -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.515 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.439 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.481 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.641 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.63 ' HD3' ' HE2' ' A' ' 12' ' ' HIS . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 1.016 ' HB3' HD12 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.712 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.556 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.581 ' CA ' HG23 ' A' ' 58' ' ' VAL . 9.2 ptmm? -84.95 -19.69 31.77 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.67 -13.43 60.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.562 168.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -103.15 -8.87 20.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.307 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.633 HG23 HG13 ' A' ' 81' ' ' VAL . 0.5 OUTLIER -101.21 7.72 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.08 176.434 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -50.73 89.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 113.529 -168.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.27 18.04 0.48 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.285 -1.325 . . . . 0.0 107.991 171.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.5 t -104.81 60.61 0.69 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.861 -172.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 60.31 -92.53 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.328 175.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -147.97 143.52 27.36 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.445 ' CG ' ' HZ2' ' A' ' 106' ' ' LYS . 32.2 t70 -113.86 -39.83 3.9 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.932 0.396 . . . . 0.0 110.754 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.5 pttp . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.198 -177.274 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.4 t . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m -140.06 130.04 24.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -79.03 -47.0 17.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.238 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -77.97 128.59 34.13 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 120.809 0.338 . . . . 0.0 110.645 175.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' C ' ' HG ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -110.87 116.52 31.38 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.533 0.683 . . . . 0.0 109.308 178.436 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.561 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 11.6 m -153.25 160.68 42.81 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.109 173.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.644 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 9.2 p90 -135.76 149.53 49.19 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -83.77 121.48 27.36 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.303 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.524 ' HB ' HG13 ' A' ' 23' ' ' ILE . 9.2 t -99.78 128.73 51.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.056 0.455 . . . . 0.0 110.38 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.506 ' HG3' HD13 ' A' ' 20' ' ' LEU . 8.7 tt0 -100.16 106.59 18.31 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 166.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.662 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -135.47 137.16 50.13 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.242 -176.383 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -93.19 -168.86 2.01 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.127 0.418 . . . . 0.0 112.127 -173.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 72.19 92.81 0.08 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 124.479 1.112 . . . . 0.0 111.148 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.428 HG12 ' N ' ' A' ' 15' ' ' SER . 6.8 p -159.11 -56.88 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.55 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.428 ' N ' HG12 ' A' ' 14' ' ' VAL . 7.2 p -162.15 156.85 19.25 Favored Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 122.309 -0.244 . . . . 0.0 110.457 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -64.57 -43.24 13.85 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.274 1.983 . . . . 0.0 111.731 176.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.13 131.98 34.73 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 170.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.409 ' C ' ' H ' ' A' ' 20' ' ' LEU . 30.5 tt0 57.99 75.16 0.56 Allowed Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -166.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -77.9 26.1 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.196 2.597 . . . . 0.0 112.116 -176.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.506 HD13 ' HG3' ' A' ' 10' ' ' GLN . 46.1 tp -147.13 133.47 19.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.626 -175.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.3 m -104.06 110.26 22.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.193 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.8 p -99.75 128.29 51.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.301 0.572 . . . . 0.0 109.637 173.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.524 HG13 ' HB ' ' A' ' 9' ' ' VAL . 9.1 pt -137.66 159.97 34.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.696 -178.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HE3' ' HB2' ' A' ' 6' ' ' SER . 18.8 tttp -114.48 97.8 6.52 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.45 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -110.31 169.31 6.5 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.055 -170.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.88 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.5 Cg_endo -71.9 140.1 34.44 Favored 'Trans proline' 0 N--CA 1.443 -1.442 0 C-N-CA 121.48 1.453 . . . . 0.0 110.612 -176.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.644 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 98.9 mtt180 -57.72 -36.48 72.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.8 -13.94 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 113.944 -1.48 . . . . 0.0 112.617 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.88 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 80.1 p -58.45 124.76 20.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.679 0.752 . . . . 0.0 110.757 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.557 ' CB ' ' HA ' ' A' ' 87' ' ' CYS . 2.2 t -100.66 179.63 4.36 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.927 171.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.647 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.51 -50.39 23.55 Favored 'General case' 0 C--O 1.209 -1.068 0 O-C-N 123.422 0.451 . . . . 0.0 110.745 -174.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.405 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.4 OUTLIER -59.69 -31.91 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -72.8 -53.35 11.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 122.168 0.985 . . . . 0.0 109.641 -176.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.644 HG12 HD21 ' A' ' 59' ' ' LEU . 2.6 p -65.42 -27.7 42.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.074 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.745 HD12 HD11 ' A' ' 103' ' ' LEU . 10.1 mm -56.74 -56.07 16.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.363 168.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.839 ' HA ' HD11 ' A' ' 39' ' ' LEU . 25.2 tp60 -59.98 -45.49 92.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.941 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -59.1 -39.17 81.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.649 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.508 ' HB ' HD12 ' A' ' 103' ' ' LEU . 29.5 m -69.02 -41.13 78.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.73 0.3 . . . . 0.0 110.293 176.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.839 HD11 ' HA ' ' A' ' 36' ' ' GLN . 29.7 mt -56.8 -38.84 73.11 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 120.986 0.422 . . . . 0.0 110.308 175.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.03 -52.98 44.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.783 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -80.34 -9.26 59.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB2' ' HB3' ' A' ' 47' ' ' SER . . . -131.33 28.27 4.7 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.396 -0.19 . . . . 0.0 111.097 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.518 ' HG3' ' CD1' ' A' ' 44' ' ' TYR . 3.4 tppp? -47.09 -74.53 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.239 0.616 . . . . 0.0 111.626 -174.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.526 ' CD2' ' HA ' ' A' ' 49' ' ' LEU . 73.5 m-85 -130.13 36.8 3.97 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 172.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 72.6 m -71.42 36.49 0.06 Allowed 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.81 -1.541 . . . . 0.0 112.381 -178.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 15.3 t80 55.94 36.34 27.15 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -166.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.42 ' HB3' ' HB2' ' A' ' 42' ' ' ALA . 60.1 m -124.45 -88.16 0.61 Allowed 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.407 -168.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.441 HD11 ' HA ' ' A' ' 48' ' ' ILE . 15.9 mm -82.18 -76.62 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.679 -176.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.526 ' HA ' ' CD2' ' A' ' 44' ' ' TYR . 4.6 mp 65.15 -41.66 0.31 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.5 p -59.62 -76.73 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -177.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -116.2 112.0 42.16 Favored Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.668 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -78.6 -17.49 12.62 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.647 2.231 . . . . 0.0 110.982 173.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.453 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 8.0 p-10 -85.41 134.78 39.69 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.602 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 1.2 Cg_endo -81.92 -6.59 12.31 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.737 2.291 . . . . 0.0 112.798 -174.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.0 m -67.01 -6.28 16.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -174.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.52 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.7 m-20 -118.39 19.52 13.37 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.522 -0.177 . . . . 0.0 110.522 176.115 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.563 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 49.5 m-85 -123.24 143.92 49.73 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.397 0.618 . . . . 0.0 111.799 -175.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 106' ' ' LYS . 3.1 m -127.66 165.99 25.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.411 166.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.644 HD21 HG12 ' A' ' 34' ' ' VAL . 12.2 tp -112.59 152.02 29.38 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.887 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.6 OUTLIER -109.3 140.19 43.28 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.042 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.678 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.1 pt-20 -105.58 87.14 2.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.117 0.961 . . . . 0.0 109.096 170.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.624 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.1 tt0 -86.58 123.72 32.09 Favored 'General case' 0 N--CA 1.42 -1.939 0 O-C-N 121.19 -0.944 . . . . 0.0 109.376 173.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.551 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -111.82 117.59 55.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.564 HG22 ' HA3' ' A' ' 99' ' ' GLY . 92.7 t -65.61 101.66 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 CA-C-O 121.601 0.715 . . . . 0.0 109.313 176.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.65 89.59 3.07 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.216 -172.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -89.5 -171.74 3.33 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.622 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 69' ' ' ASN . 5.9 t -142.8 162.46 35.41 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.267 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.3 t -71.91 -26.14 62.19 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -174.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.461 ' O ' HG22 ' A' ' 67' ' ' THR . 4.2 p-10 -123.75 152.69 41.87 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 120.74 0.305 . . . . 0.0 111.014 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -139.18 85.93 2.1 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.66 0.743 . . . . 0.0 112.632 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' A' ' 71' ' ' LYS . 24.3 mmmt -113.52 -60.59 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.004 170.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -110.23 -22.06 11.94 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.65 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.424 ' HB ' HG23 ' A' ' 67' ' ' THR . 17.5 p -94.66 111.71 23.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.435 178.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.9 p -100.15 150.26 36.74 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.705 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.79 131.97 40.23 Favored 'Trans proline' 0 CA--C 1.509 -0.726 0 C-N-CA 122.551 2.168 . . . . 0.0 110.973 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -156.66 146.16 20.65 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.219 -161.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.2 m -87.42 135.02 33.5 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.418 0.627 . . . . 0.0 112.007 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.7 m -102.96 100.0 9.93 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.605 171.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 43.1 tt0 -94.33 132.69 38.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.942 -174.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.586 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 6.2 tpp180 -127.73 160.71 30.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.767 HG12 HD12 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -115.71 144.71 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 118.381 0.537 . . . . 0.0 110.474 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.656 HD22 ' HB3' ' A' ' 61' ' ' GLU . 20.8 mt -104.84 152.07 23.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.672 -174.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.3 mp -81.36 169.67 16.94 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 166.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -41.39 62.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.9 0.381 . . . . 0.0 111.389 -176.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.528 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 14.1 pt20 -114.09 32.03 6.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.571 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 22.6 tp10 -63.39 -20.69 65.75 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.992 0.425 . . . . 0.0 110.331 175.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 73.9 m 72.09 122.27 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.208 178.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.515 ' H ' ' HA ' ' A' ' 30' ' ' THR . 90.9 t -75.27 -38.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.25 -171.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -72.92 -33.96 66.29 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.564 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.1 OUTLIER -65.43 -40.57 93.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.192 176.781 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.526 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -68.88 -40.32 79.32 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.687 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.63 -36.03 79.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.135 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -70.51 -15.36 62.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.545 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.526 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 88.6 mttt -75.55 -24.98 56.75 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.011 0.434 . . . . 0.0 110.434 177.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.407 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.1 m0 -63.68 153.95 34.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -167.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mtmm -135.81 24.99 3.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.176 -1.375 . . . . 0.0 108.205 175.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.47 ' O ' HG21 ' A' ' 63' ' ' VAL . . . -169.28 153.5 22.12 Favored Glycine 0 N--CA 1.44 -1.055 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.37 10.59 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.283 1.041 . . . . 0.0 111.062 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.564 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -106.38 -154.35 20.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.894 -176.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HZ3' ' CD ' ' A' ' 62' ' ' GLU . 1.3 mtmt -146.32 143.88 29.43 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.662 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -80.42 153.06 28.5 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 169.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 92.9 mt -135.57 128.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 O-C-N 122.02 -0.425 . . . . 0.0 111.426 -173.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.745 HD11 HD12 ' A' ' 35' ' ' ILE . 3.4 tp -77.7 130.46 36.82 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.115 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.462 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 1.1 tppt? -151.61 175.79 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.7 mp -101.92 133.33 46.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.86 0.362 . . . . 0.0 110.416 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.464 ' HB3' HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -63.52 -29.82 71.03 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.074 173.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -70.45 -22.28 62.71 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -100.63 -6.42 25.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.843 0.83 . . . . 0.0 108.898 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.763 HG13 HG13 ' A' ' 81' ' ' VAL . 69.9 t -124.08 31.63 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.899 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -77.99 65.51 3.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.624 -174.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.07 -9.26 34.24 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.195 -0.911 . . . . 0.0 108.916 172.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.9 m -57.56 132.32 52.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.868 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -164.12 -172.64 2.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.499 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 67.24 92.13 0.08 Allowed 'General case' 0 C--N 1.331 -0.21 0 O-C-N 124.009 0.818 . . . . 0.0 110.634 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.5 t70 70.84 155.15 0.14 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.496 -178.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.526 ' HZ2' ' HB3' ' A' ' 116' ' ' LYS . 6.8 ttpm? . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.624 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 120.814 0.34 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.47 ' HB3' ' OE2' ' A' ' 4' ' ' GLU . 45.4 m -127.73 105.29 8.35 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -101.72 8.82 41.41 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.52 -174.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.47 ' OE2' ' HB3' ' A' ' 2' ' ' SER . 6.7 pm0 -75.44 163.26 27.6 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.536 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -102.89 133.47 47.92 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.189 0.519 . . . . 0.0 110.617 -172.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.7 p -118.75 139.8 50.97 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.219 0.533 . . . . 0.0 111.187 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.844 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -124.14 156.7 36.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.214 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.448 ' CZ ' ' HE2' ' A' ' 24' ' ' LYS . 43.7 m-85 -84.75 125.22 32.36 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.22 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.566 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.9 t -113.76 129.32 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.457 178.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.547 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 44.9 mt-30 -97.96 108.54 21.28 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 164.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.761 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -120.08 115.19 46.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-O 121.51 0.672 . . . . 0.0 110.406 177.831 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.561 ' HB2' HG13 ' A' ' 102' ' ' ILE . 9.4 m-70 -87.67 168.21 13.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.266 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.662 ' HB3' ' CE1' ' A' ' 46' ' ' TYR . 28.4 t70 -142.95 168.79 18.87 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 166.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -78.45 -22.58 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.931 0.396 . . . . 0.0 111.145 -176.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.957 ' HB2' ' HD1' ' A' ' 46' ' ' TYR . 12.7 m -65.14 148.49 97.84 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.821 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 -28.54 8.47 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.734 2.289 . . . . 0.0 113.826 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.74 113.16 7.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.287 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 60.26 79.7 0.28 Allowed Pre-proline 0 C--O 1.225 -0.234 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.836 -174.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -52.63 -44.59 46.44 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.336 2.024 . . . . 0.0 111.914 -177.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.538 HD12 ' CD2' ' A' ' 12' ' ' HIS . 27.0 tp -116.58 121.15 40.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.489 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.57 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.6 m -92.06 109.45 20.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 173.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 50.0 t -95.81 110.69 24.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.566 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.2 pt -116.68 168.28 8.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.891 0.377 . . . . 0.0 110.706 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HE2' ' CZ ' ' A' ' 8' ' ' PHE . 19.0 tttm -117.1 96.05 5.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 169.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.4 ' HB2' ' CD ' ' A' ' 26' ' ' PRO . . . -100.47 167.49 10.82 Favored Pre-proline 0 CA--C 1.506 -0.712 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.461 -175.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.884 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 5.6 Cg_exo -68.74 141.98 51.27 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 121.535 1.49 . . . . 0.0 111.523 -177.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.844 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 35.5 mtp180 -66.33 -0.45 2.64 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.601 0.715 . . . . 0.0 109.966 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.451 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.5 m -114.12 -2.44 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.461 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.884 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.2 p -59.86 119.69 8.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.277 0.561 . . . . 0.0 109.859 175.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.48 ' C ' HG21 ' A' ' 88' ' ' VAL . 17.8 p -94.15 -173.82 3.21 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.525 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -55.8 -49.92 71.89 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.711 -176.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.423 HE21 ' CA ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -61.92 -30.71 71.08 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -178.817 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -70.68 -53.74 14.54 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.485 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.2 p -66.59 -27.6 40.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 113.599 -1.637 . . . . 0.0 110.135 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 31' ' ' ALA . 4.3 mm -55.88 -58.15 5.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.584 174.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.553 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 54.7 mt-30 -73.28 -32.77 64.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.752 0.31 . . . . 0.0 110.894 -175.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -60.99 -37.3 81.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-O 120.775 0.322 . . . . 0.0 110.216 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.591 ' HA ' ' HB3' ' A' ' 41' ' ' LYS . 32.6 m -75.68 -30.18 59.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.272 175.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 5.9 mp -55.68 -47.93 75.91 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-O 120.961 0.41 . . . . 0.0 109.943 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.8 m -67.16 -37.21 83.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.542 0.687 . . . . 0.0 110.161 176.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.591 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 27.9 tptp -69.86 -10.28 57.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.069 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.799 ' HA ' ' HB2' ' A' ' 45' ' ' SER . . . -124.56 12.95 8.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.262 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.453 ' HE2' ' CE2' ' A' ' 44' ' ' TYR . 6.9 ttpm? -46.21 -41.89 13.42 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.993 0.808 . . . . 0.0 111.467 -173.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.453 ' CE2' ' HE2' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -136.92 -1.61 2.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.136 0.494 . . . . 0.0 110.078 168.532 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.799 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 20.6 m -64.09 -68.15 0.37 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.937 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.957 ' HD1' ' HB2' ' A' ' 15' ' ' SER . 97.6 m-85 -86.24 13.27 8.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.8 p 45.26 57.29 4.91 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.027 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 39' ' ' LEU . 7.2 tt -78.96 9.2 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.764 -175.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.605 HD13 ' H ' ' A' ' 49' ' ' LEU . 4.3 mp -56.39 -23.27 36.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.636 -175.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.6 m -65.53 -34.33 78.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.193 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -128.81 90.62 45.47 Favored Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 120.956 0.408 . . . . 0.0 111.003 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -84.56 7.44 5.18 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.653 2.235 . . . . 0.0 111.977 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 32.8 m-20 -112.55 146.53 35.17 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.135 -176.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 26.4 Cg_endo -94.18 1.65 3.01 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.619 2.879 . . . . 0.0 112.283 -177.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.417 ' O ' ' HD2' ' A' ' 106' ' ' LYS . 2.6 p -77.64 -16.98 58.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.959 -173.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.14 3.96 39.05 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.849 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.52 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 20.8 m-85 -118.54 134.45 55.08 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.259 0.552 . . . . 0.0 112.149 -171.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.527 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -108.69 178.8 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.445 163.158 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 1.101 HD13 ' HB3' ' A' ' 101' ' ' PHE . 3.0 tm? -131.04 132.84 45.21 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -98.83 125.97 44.35 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.546 -175.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.0 pt-20 -88.74 86.0 6.89 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.36 1.076 . . . . 0.0 108.508 170.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.602 ' O ' ' HA2' ' A' ' 99' ' ' GLY . 17.9 tt0 -85.53 122.66 29.98 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.525 -0.735 . . . . 0.0 109.145 175.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.561 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.3 OUTLIER -115.61 117.92 57.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 121.449 0.642 . . . . 0.0 110.08 176.194 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.537 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 59.3 t -83.84 103.92 11.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.016 -175.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -92.7 88.12 6.15 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.503 174.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -66.37 149.34 50.54 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.494 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -114.32 139.86 49.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.134 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.4 m -76.63 -32.08 57.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.17 -178.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -100.72 -96.47 0.26 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.06 110.93 22.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.06 0.457 . . . . 0.0 112.065 -168.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HD2' ' H ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -117.55 162.47 17.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.731 175.934 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.12 -46.72 40.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.314 0.578 . . . . 0.0 110.667 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.0 t -167.44 -35.15 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.991 175.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.01 164.8 40.54 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.89 176.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -53.01 145.51 41.21 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.694 2.263 . . . . 0.0 112.354 174.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 76' ' ' LYS . 57.3 mmtt -81.24 128.87 34.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.587 -176.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.537 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 6.8 p -109.05 107.4 17.72 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.485 -179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.1 m -82.16 104.93 12.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.489 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.552 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 18.5 tt0 -94.34 131.21 40.21 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -176.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.493 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 29.4 ttt180 -126.68 149.85 49.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.513 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -105.8 139.5 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.822 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.669 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 23.6 mt -96.86 156.89 16.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.306 0.574 . . . . 0.0 111.578 -176.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.446 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 47.2 mt -76.98 168.45 20.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 162.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.16 -40.13 64.08 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -120.73 35.69 4.8 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.695 0.283 . . . . 0.0 111.669 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.669 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 23.9 tp10 -65.57 -17.68 64.76 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.6 ' HB2' HE21 ' A' ' 90' ' ' GLN . 18.9 m 78.2 109.48 0.07 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.521 176.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.48 HG21 ' C ' ' A' ' 30' ' ' THR . 86.8 t -55.71 -45.84 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.332 173.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -73.72 -35.54 65.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.66 -175.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.6 HE21 ' HB2' ' A' ' 87' ' ' CYS . 18.1 mt-30 -62.31 -45.37 93.56 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 173.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.24 90.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.677 177.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -54.41 -47.35 72.86 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.81 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.7 t -75.29 -4.44 39.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 0.0 110.466 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -99.35 -6.69 27.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.963 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.457 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -72.59 161.12 31.19 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.724 0.773 . . . . 0.0 112.541 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -128.77 21.59 5.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.02 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -178.0 169.59 41.5 Favored Glycine 0 N--CA 1.44 -1.078 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.248 -178.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.465 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -88.58 102.96 15.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 117.347 0.574 . . . . 0.0 111.376 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.602 ' HA2' ' O ' ' A' ' 62' ' ' GLU . . . -111.09 -149.18 11.57 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.422 -0.894 . . . . 0.0 111.898 177.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.547 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.4 mptp? -152.61 155.01 36.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 1.101 ' HB3' HD13 ' A' ' 59' ' ' LEU . 99.4 m-85 -86.91 116.73 25.17 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 173.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.561 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -101.46 122.91 54.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 O-C-N 122.013 -0.429 . . . . 0.0 110.365 -173.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.497 ' CD1' HD12 ' A' ' 35' ' ' ILE . 7.5 tp -74.2 135.52 42.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.822 ' HD2' HG22 ' A' ' 109' ' ' VAL . 22.6 ttmm -160.81 149.39 16.41 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.624 -179.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.52 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 10.9 mp -70.39 141.68 52.15 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.204 174.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.527 ' CA ' HG23 ' A' ' 58' ' ' VAL . 14.3 ptpt -72.64 -31.04 64.81 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.907 -179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -72.83 -17.07 61.59 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 177.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -108.28 5.84 26.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.633 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.822 HG22 ' HD2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -108.4 -12.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.606 -178.508 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -60.81 83.44 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 122.028 0.918 . . . . 0.0 112.467 -168.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -101.14 -4.98 26.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.053 177.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.3 t -119.7 120.82 37.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.068 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 51.9 ttm-85 58.77 71.35 0.59 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.554 0.692 . . . . 0.0 110.665 -176.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.02 -0.03 40.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.546 176.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -77.32 82.18 3.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.793 178.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--N 1.324 -0.514 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.092 -175.776 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.477 0.892 0 CA-C-O 121.177 0.513 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.4 m -128.63 125.19 37.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.584 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.8 -21.69 43.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.486 0.66 . . . . 0.0 109.563 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -137.22 172.47 12.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.933 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.66 109.03 20.57 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 171.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -144.56 160.74 40.64 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.677 -177.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.537 ' CD1' ' HA ' ' A' ' 27' ' ' ARG . 6.0 p90 -147.87 155.46 41.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.488 ' CZ ' ' HD2' ' A' ' 24' ' ' LYS . 65.7 m-85 -87.08 129.61 34.84 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.188 -175.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' HG13 ' A' ' 23' ' ' ILE . 22.1 t -109.09 131.34 60.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.087 0.47 . . . . 0.0 110.767 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.672 ' HG2' ' HG2' ' A' ' 100' ' ' LYS . 28.2 tt0 -101.57 106.49 17.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 166.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.593 ' HB ' ' HB2' ' A' ' 101' ' ' PHE . 1.8 p -139.57 137.89 39.82 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-O 120.883 0.373 . . . . 0.0 111.337 -172.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.578 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 94.0 m-70 -95.39 150.39 20.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 177.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.505 ' O ' ' HB ' ' A' ' 14' ' ' VAL . 8.5 p-10 -97.42 -70.39 0.72 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.505 ' HB ' ' O ' ' A' ' 13' ' ' ASP . 9.3 p 171.42 -23.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.319 0 C-N-CA 122.996 0.518 . . . . 0.0 110.564 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.1 m -75.84 156.76 84.37 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.672 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -89.5 -159.79 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 123.162 2.575 . . . . 0.0 112.02 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 66.29 -75.24 0.06 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.237 0.615 . . . . 0.0 110.712 -176.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.45 ' HB2' ' OH ' ' A' ' 46' ' ' TYR . 15.8 mm100 -114.56 82.3 7.72 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 170.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -76.5 -10.19 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.289 2.659 . . . . 0.0 113.332 -169.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp -110.33 126.23 54.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.975 0.417 . . . . 0.0 110.996 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.522 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 87.8 m -98.24 121.15 39.82 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.05 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.1 t -110.82 111.33 35.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 0.0 109.846 176.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.555 HG13 ' HB ' ' A' ' 9' ' ' VAL . 2.5 pt -124.12 159.83 29.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.298 -178.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.488 ' HD2' ' CZ ' ' A' ' 8' ' ' PHE . 1.4 ttpm? -109.95 96.55 6.31 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 171.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.69 163.67 18.03 Favored Pre-proline 0 CA--C 1.504 -0.82 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.929 -175.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.974 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.3 Cg_exo -68.42 145.91 66.69 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.704 1.603 . . . . 0.0 110.974 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.537 ' HA ' ' CD1' ' A' ' 7' ' ' PHE . 73.6 mtt180 -62.02 -15.69 46.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.781 0.801 . . . . 0.0 109.634 -178.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.3 m -98.13 -4.59 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.3 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.974 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.7 p -55.72 123.25 13.52 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.786 0.803 . . . . 0.0 110.476 178.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.556 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 1.0 OUTLIER -103.53 174.61 5.79 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.991 173.246 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.594 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.15 -51.19 18.85 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 123.522 0.514 . . . . 0.0 111.331 -173.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.798 HE22 ' HB2' ' A' ' 54' ' ' PRO . 15.2 tp60 -60.92 -31.6 71.12 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.463 -178.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -78.76 -51.86 9.19 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 -177.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.429 ' CG1' ' HG ' ' A' ' 59' ' ' LEU . 2.9 p -60.55 -28.54 42.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.765 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.64 HD12 ' HG ' ' A' ' 103' ' ' LEU . 5.8 mm -56.45 -57.86 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.052 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.511 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 28.4 tt0 -70.76 -32.37 69.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.201 -174.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -60.87 -38.01 84.11 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.978 0.418 . . . . 0.0 110.251 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.5 m -71.01 -31.92 68.56 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.078 175.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.511 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -62.42 -33.7 75.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.409 0.623 . . . . 0.0 110.806 173.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t -78.24 -36.74 46.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.812 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -70.98 -50.33 35.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.216 0.531 . . . . 0.0 110.179 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.778 ' HA ' ' HB2' ' A' ' 45' ' ' SER . . . -113.88 80.78 1.43 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.023 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.716 ' O ' HD13 ' A' ' 49' ' ' LEU . 37.4 ttmt -87.64 -80.8 0.25 Allowed 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 171.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.87 -18.07 48.54 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.778 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 42.5 m -62.0 113.8 3.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.316 171.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.45 ' OH ' ' HB2' ' A' ' 18' ' ' GLN . 29.1 m-85 64.98 2.93 1.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.647 0.592 . . . . 0.0 110.823 -175.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.1 t 48.9 75.13 0.15 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.913 0.863 . . . . 0.0 111.639 -174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.635 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 41.6 mm -97.59 -9.18 9.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.054 -0.975 . . . . 0.0 109.16 175.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.716 HD13 ' O ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.99 10.15 1.6 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.822 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 p -55.19 -37.36 66.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-O 121.609 0.718 . . . . 0.0 109.113 172.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.439 ' HB2' ' HE1' ' A' ' 57' ' ' TYR . 17.2 m120 -120.62 90.56 46.12 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.351 167.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -73.25 -11.75 25.08 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.608 2.205 . . . . 0.0 112.598 -172.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.21 125.03 39.28 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-O 121.328 0.585 . . . . 0.0 109.915 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.798 ' HB2' HE22 ' A' ' 32' ' ' GLN . 81.2 Cg_endo -76.7 -3.23 13.55 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.832 2.354 . . . . 0.0 112.831 -173.012 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.562 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 14.8 m -76.95 0.32 21.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.701 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 8.1 m-20 -108.11 0.49 21.67 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.025 0.441 . . . . 0.0 110.275 174.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.582 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 47.0 m-85 -107.62 156.52 18.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.093 -177.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.585 HG23 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.38 169.21 21.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 167.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 1.074 HD12 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -123.0 139.62 53.89 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -174.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.649 HD12 HG12 ' A' ' 81' ' ' VAL . 1.0 OUTLIER -103.11 128.63 49.96 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.017 -177.207 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HG3' ' HB3' ' A' ' 80' ' ' ARG . 9.4 pt-20 -92.94 87.3 5.73 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.037 0.922 . . . . 0.0 108.96 171.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 9.7 tt0 -85.7 123.3 30.93 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.554 ' HA ' ' HA2' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.37 116.66 52.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t -76.86 98.42 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.309 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.509 ' HD3' ' HD3' ' A' ' 96' ' ' LYS . 10.2 mtmp? -82.41 82.09 8.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 172.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' A' ' 75' ' ' PRO . 3.2 p30 -71.16 179.95 2.61 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.987 -1.006 . . . . 0.0 112.37 -169.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 m -133.38 92.27 2.98 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 113.923 -1.49 . . . . 0.0 109.715 -174.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 40.1 m -72.79 93.83 1.72 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.889 178.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.464 ' N ' HD21 ' A' ' 69' ' ' ASN . 0.0 OUTLIER -148.33 178.08 8.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.787 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -123.47 61.48 1.05 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.148 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -137.64 -175.29 4.02 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.945 172.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.1 m -77.54 -11.65 59.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.992 0.425 . . . . 0.0 110.706 -179.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.64 114.74 4.61 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.939 176.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.8 p -89.37 163.21 34.54 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.708 -175.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.523 ' HB3' ' HB2' ' A' ' 66' ' ' ASP . 25.2 Cg_exo -63.57 159.75 39.3 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.909 2.406 . . . . 0.0 111.811 174.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.73 128.67 47.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.233 0.54 . . . . 0.0 112.025 -171.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.565 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 19.8 m -93.4 115.26 27.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.442 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 m -92.97 103.9 16.18 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.2 tt0 -94.85 131.29 40.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.892 0.377 . . . . 0.0 110.217 -174.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.668 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 38.8 ttm180 -127.2 158.12 37.96 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.753 HG13 HG12 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -112.62 144.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 118.355 0.525 . . . . 0.0 110.819 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.534 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 19.8 mt -100.01 -177.07 3.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.31 0.576 . . . . 0.0 111.524 -176.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.748 ' H ' ' HB3' ' A' ' 86' ' ' GLU . 17.1 mt -117.62 -170.83 1.94 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.962 -179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.44 -30.66 71.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.164 0.507 . . . . 0.0 109.874 175.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.404 ' HA ' ' HG1' ' A' ' 30' ' ' THR . 4.2 pt20 -129.69 19.78 5.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -177.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.748 ' HB3' ' H ' ' A' ' 83' ' ' LEU . 13.7 tp10 -79.27 80.82 5.6 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 123.085 1.421 . . . . 0.0 107.771 169.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.62 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 58.1 m -35.63 135.45 0.28 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-N 110.257 -3.156 . . . . 0.0 113.68 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.507 ' H ' ' HA ' ' A' ' 30' ' ' THR . 55.3 t -76.16 -41.47 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.468 -175.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -72.44 -33.99 67.46 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.62 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 1.6 mt-30 -64.37 -42.19 96.3 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.299 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.55 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -63.19 -45.75 90.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.681 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -59.63 -29.72 68.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.693 -178.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.1 p -76.95 -20.69 55.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.343 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.55 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 75.1 mttt -73.02 -30.0 63.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.37 0.605 . . . . 0.0 110.209 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.437 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -49.09 128.84 17.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.872 -167.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.535 ' H ' HG22 ' A' ' 63' ' ' VAL . 22.4 mtpp -97.21 20.11 11.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.043 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 179.16 -171.56 43.55 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.595 -177.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -103.14 111.25 23.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.772 0.786 . . . . 0.0 110.768 178.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 63' ' ' VAL . . . -116.45 -149.28 9.2 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.12 -177.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.672 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 2.0 mtmt -151.11 145.53 25.53 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 1.074 ' HB3' HD12 ' A' ' 59' ' ' LEU . 98.0 m-85 -79.2 154.22 29.41 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.577 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 67.3 mt -142.93 129.62 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 O-C-N 121.679 -0.638 . . . . 0.0 111.65 -174.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.64 ' HG ' HD12 ' A' ' 35' ' ' ILE . 5.8 mp -73.36 141.54 47.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.902 0.382 . . . . 0.0 110.98 176.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.521 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 9.3 tppt? -154.06 176.29 12.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.582 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.0 mp -101.28 142.57 32.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.164 0.507 . . . . 0.0 110.05 174.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.585 ' CA ' HG23 ' A' ' 58' ' ' VAL . 16.9 ptmt -82.07 -21.7 36.72 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.008 -177.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -70.3 -23.76 62.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.836 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 4.0 pt20 -101.35 -26.99 13.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.077 0.465 . . . . 0.0 109.857 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.753 HG12 HG13 ' A' ' 81' ' ' VAL . 6.8 t -75.8 -51.21 21.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.258 176.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.609 ' OE1' ' HA ' ' A' ' 115' ' ' ASP . 4.1 pt20 40.61 31.1 0.1 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 174.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 58.13 18.43 5.27 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -133.47 168.93 17.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.959 0.409 . . . . 0.0 110.325 -178.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -94.56 -5.21 46.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -141.3 -179.61 6.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.876 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.609 ' HA ' ' OE1' ' A' ' 110' ' ' GLN . 2.8 p-10 -88.97 -25.33 22.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.756 0.312 . . . . 0.0 110.947 -178.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.5 tptt . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.608 -177.773 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.506 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HB3' HD11 ' A' ' 20' ' ' LEU . 41.5 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.797 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.548 ' HB2' HG13 ' A' ' 102' ' ' ILE . 78.2 m-70 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.58 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.862 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.675 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 35' ' ' ILE . 4.8 pp0? -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.535 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.832 HD13 ' HB2' ' A' ' 57' ' ' TYR . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.518 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 37.2 m-20 . . . . . 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' ' 35' ' ' ILE . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.598 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 1.044 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.735 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.648 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.543 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.862 0.363 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.611 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 36.4 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.51 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.546 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.411 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.657 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.641 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.57 ' H ' ' HA ' ' A' ' 30' ' ' THR . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 1.9 mt-30 -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.496 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.482 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.648 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 1.044 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.735 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.598 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmm? . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 121.279 0.562 . . . . 0.0 109.76 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.772 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 12.5 p90 -113.8 154.77 26.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.061 -175.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -87.2 129.81 34.81 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 111.333 -176.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.584 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.5 t -115.73 127.82 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.348 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.584 ' HB3' HD11 ' A' ' 20' ' ' LEU . 34.6 mt-30 -102.05 107.09 18.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.783 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.6 OUTLIER -130.22 130.67 65.77 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.709 -174.812 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 . . . . . 0 C--N 1.316 -0.851 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.466 -175.969 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.584 HD11 ' HB3' ' A' ' 10' ' ' GLN . 56.4 tp . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.625 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 29.7 m -82.09 109.44 16.41 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.341 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.12 111.22 24.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.923 0.392 . . . . 0.0 109.979 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.584 HG13 ' HB ' ' A' ' 9' ' ' VAL . 17.7 pt -122.36 173.25 8.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.778 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -122.03 97.61 5.56 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.22 160.28 30.16 Favored Pre-proline 0 CA--C 1.504 -0.795 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.755 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.856 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.8 Cg_exo -66.01 141.83 65.81 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 121.848 1.699 . . . . 0.0 111.386 -177.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.772 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 38.0 mtp180 -63.69 -0.57 1.03 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.609 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.435 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.6 m -114.35 -9.96 12.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.642 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.856 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.6 p -53.86 133.45 42.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 110.935 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 21.4 p -96.81 -169.99 1.97 Allowed 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.572 ' HA ' HG13 ' A' ' 88' ' ' VAL . . . -59.03 -48.55 81.19 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.248 178.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.45 -32.59 67.09 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 123.15 0.281 . . . . 0.0 111.398 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -74.44 -53.74 8.96 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 122.245 1.022 . . . . 0.0 109.94 -176.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 88' ' ' VAL . 5.1 p -65.95 -27.47 41.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.126 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.823 HD13 HD12 ' A' ' 103' ' ' LEU . 3.1 mm -56.07 -58.22 5.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.141 171.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 28.2 tt0 -72.45 -32.33 66.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.293 -175.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -59.47 -35.26 73.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 122.106 -0.371 . . . . 0.0 110.683 176.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.9 m -68.89 -41.09 78.75 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 9.7 mp -54.13 -40.88 67.8 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.653 172.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.8 t -67.81 -33.31 74.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.468 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -73.18 -32.73 65.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.397 0.618 . . . . 0.0 109.972 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.423 177.774 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 CA--C 1.516 -0.35 0 CA-C-O 120.985 0.421 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 29.9 m-85 -109.89 150.15 28.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.183 0.516 . . . . 0.0 111.098 -177.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -126.06 160.33 33.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.675 168.792 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 1.028 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.2 tm? -116.78 135.03 54.07 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.866 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.8 OUTLIER -98.41 130.71 45.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.09 -176.94 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.663 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.8 pt-20 -96.93 91.11 5.46 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.435 1.112 . . . . 0.0 108.52 169.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.658 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 3.3 tt0 -88.21 123.03 32.43 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 121.227 -0.921 . . . . 0.0 109.705 172.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.507 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -112.45 117.46 55.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.316 0.579 . . . . 0.0 109.564 169.836 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.67 HG23 ' HA2' ' A' ' 99' ' ' GLY . 51.8 t . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.21 -176.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.827 0.346 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.422 ' HB2' HG13 ' A' ' 63' ' ' VAL . 17.9 m -83.86 96.94 8.94 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 176.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.0 tt0 -97.79 131.7 44.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.879 -0.601 . . . . 0.0 109.993 -175.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.573 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 24.5 ttt180 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.69 HG13 HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -110.35 140.55 28.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.482 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.5 mt -100.89 150.11 23.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.215 0.531 . . . . 0.0 111.653 -174.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.36 156.36 38.45 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 162.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.16 -32.99 38.37 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.811 0.338 . . . . 0.0 111.738 -175.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -110.38 19.64 18.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.8 -9.56 45.38 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.835 178.211 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 85.4 m 68.44 106.73 0.05 Allowed 'General case' 0 C--O 1.219 -0.537 0 O-C-N 123.931 0.769 . . . . 0.0 111.471 175.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 34' ' ' VAL . 17.0 m -72.34 -32.08 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.159 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -73.47 -37.19 65.86 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 118.881 -1.128 . . . . 0.0 109.042 178.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.637 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 57.4 mt-30 -62.0 -45.74 92.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.84 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.8 -44.03 81.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.74 -37.58 76.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.049 -178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 65.1 p -76.28 -11.99 60.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.835 0.35 . . . . 0.0 111.318 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 86.5 mttt -82.91 -21.8 34.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.228 0.537 . . . . 0.0 109.705 177.082 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.443 ' CG ' ' HB ' ' A' ' 63' ' ' VAL . 43.4 m0 -64.34 157.77 25.33 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.719 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.422 ' H ' HG21 ' A' ' 63' ' ' VAL . 62.2 mttm -137.7 19.23 2.87 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.174 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -160.6 165.61 35.11 Favored Glycine 0 N--CA 1.441 -0.978 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -86.76 104.76 16.45 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 117.99 0.895 . . . . 0.0 110.816 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.67 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -107.76 -147.61 13.47 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.147 -1.025 . . . . 0.0 112.147 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -150.43 153.93 36.81 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 176.136 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 1.028 ' HB3' HD11 ' A' ' 59' ' ' LEU . 96.8 m-85 -87.0 154.74 20.54 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 166.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.866 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 4.9 mp -135.18 127.18 47.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 121.66 -0.65 . . . . 0.0 110.951 -178.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.823 HD12 HD13 ' A' ' 35' ' ' ILE . 7.6 tp -83.14 127.53 33.68 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.464 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 5.6 tppt? -149.11 175.82 11.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.573 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.1 mp -98.17 144.17 27.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 0.0 110.491 172.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.725 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmt . . . . . 0 C--N 1.316 -0.867 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.166 -176.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.406 ' OG ' ' HE2' ' A' ' 24' ' ' LYS . 57.1 p . . . . . 0 N--CA 1.445 -0.704 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.626 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 6.9 p90 -148.66 153.5 38.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -90.9 128.25 36.69 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.505 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.575 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.6 t -108.97 125.66 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.254 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.606 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 84.1 mt-30 -93.61 107.38 19.24 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.794 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -124.14 115.69 45.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.429 0.633 . . . . 0.0 110.576 -178.353 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.584 ' HB2' HG13 ' A' ' 102' ' ' ILE . 45.0 m-70 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.601 -175.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.561 HD11 ' HB3' ' A' ' 10' ' ' GLN . 52.7 tp . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.526 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 34.1 m -71.43 108.95 5.1 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.202 -176.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.4 t -96.14 111.06 25.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.4 pt -118.8 176.51 3.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.701 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.406 ' HE2' ' OG ' ' A' ' 6' ' ' SER . 51.4 tttt -124.9 97.75 5.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -98.86 170.98 6.22 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.138 -176.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.873 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.8 Cg_endo -75.64 140.8 24.14 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 C-N-CA 122.165 1.91 . . . . 0.0 110.14 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.626 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 90.7 mtt180 -54.24 -42.92 70.43 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 m -68.63 -10.37 13.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.951 178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.873 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 85.9 p -57.02 128.77 38.66 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.422 0.63 . . . . 0.0 110.783 177.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.514 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -102.3 179.19 4.38 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 171.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.787 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.42 -50.3 31.61 Favored 'General case' 0 C--O 1.213 -0.865 0 O-C-N 123.297 0.373 . . . . 0.0 111.013 -174.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.48 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -56.35 -35.45 67.65 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.96 -52.97 11.15 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.935 0.874 . . . . 0.0 110.021 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 59' ' ' LEU . 5.3 p -63.13 -27.44 43.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.89 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.787 HG12 ' O ' ' A' ' 31' ' ' ALA . 3.5 mm -55.75 -58.26 5.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.128 173.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.488 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 52.6 tp60 -69.39 -33.63 73.31 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.024 -177.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.435 HE22 ' HA ' ' A' ' 25' ' ' ALA . 17.6 tt0 -65.52 -36.67 84.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.48 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.2 m -70.52 -35.62 73.27 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.552 HD13 ' O ' ' A' ' 35' ' ' ILE . 6.9 mp -54.44 -46.21 73.22 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.443 171.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.06 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -79.95 -23.3 41.79 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.777 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.44 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -172.536 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 15.5 m-20 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 120.769 0.318 . . . . 0.0 111.446 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.619 ' HB3' HD12 ' A' ' 35' ' ' ILE . 50.0 m-85 -103.69 152.94 21.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.482 0.658 . . . . 0.0 111.425 -175.546 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -136.03 161.89 37.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 168.621 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 34' ' ' VAL . 21.1 tp -115.29 148.39 39.26 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.484 -0.487 . . . . 0.0 109.98 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.3 mm? -106.44 134.56 49.39 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.796 ' HB3' HD21 ' A' ' 82' ' ' LEU . 12.6 pt-20 -98.87 87.34 3.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 122.378 1.085 . . . . 0.0 108.665 170.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.615 ' HB2' ' HG3' ' A' ' 79' ' ' GLN . 0.4 OUTLIER -87.07 124.47 33.26 Favored 'General case' 0 N--CA 1.414 -2.255 0 O-C-N 121.656 -0.652 . . . . 0.0 109.757 174.73 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.595 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.6 OUTLIER -113.86 111.25 35.21 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.422 174.054 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 92.5 t . . . . . 0 CA--C 1.512 -0.517 0 CA-C-O 121.389 0.614 . . . . 0.0 110.046 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.6 p . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 121.029 0.443 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.517 ' HB3' HG13 ' A' ' 63' ' ' VAL . 11.9 t -87.6 99.28 11.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.615 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 49.3 tt0 -94.93 131.69 40.58 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.273 -0.422 . . . . 0.0 109.927 -175.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.657 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 27.1 ttt180 -126.72 157.57 38.74 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.563 HG13 HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -111.99 144.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 118.482 0.583 . . . . 0.0 110.104 177.645 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.963 HD22 ' HG2' ' A' ' 86' ' ' GLU . 16.5 mt -103.17 154.64 19.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.237 0.541 . . . . 0.0 111.575 -173.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.7 mp -87.24 176.0 7.77 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.758 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -47.27 -51.31 19.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.463 0.477 . . . . 0.0 111.475 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -115.03 41.64 2.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.963 ' HG2' HD22 ' A' ' 82' ' ' LEU . 14.1 tp10 -62.34 -28.46 69.77 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.566 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 22.9 m 73.21 122.04 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.482 -175.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.503 ' H ' ' HA ' ' A' ' 30' ' ' THR . 94.0 t -74.68 -36.97 42.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.024 -173.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' A' ' 27' ' ' ARG . 86.7 t80 -73.39 -34.3 65.46 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.545 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 38.4 mt-30 -64.92 -44.73 88.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.87 175.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.479 ' HA ' ' NZ ' ' A' ' 94' ' ' LYS . . . -62.9 -46.69 86.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.039 0.447 . . . . 0.0 110.452 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -56.16 -38.8 71.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.372 -178.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.7 p -74.3 -5.01 39.64 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.479 ' NZ ' ' HA ' ' A' ' 91' ' ' ALA . 10.8 mttp -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.2 0.524 . . . . 0.0 110.643 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.429 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 44.6 m0 -64.41 155.36 32.77 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.871 -173.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.47 ' H ' HG21 ' A' ' 63' ' ' VAL . 98.8 mttt -130.8 18.34 5.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.13 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -163.7 166.79 37.53 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 109.278 -1.529 . . . . 0.0 109.278 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.31 93.27 8.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 118.018 0.909 . . . . 0.0 111.088 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.605 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -100.98 -150.23 23.97 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.206 -0.997 . . . . 0.0 112.024 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.606 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -151.89 155.56 38.35 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 175.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.794 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.5 m-85 -86.52 124.48 32.88 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -102.17 122.09 54.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.801 -0.562 . . . . 0.0 110.397 -174.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.9 tp -75.29 135.49 40.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.5 ttmm -156.86 176.6 12.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.586 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 6.6 mp -104.19 143.98 32.21 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.49 ' N ' HG22 ' A' ' 58' ' ' VAL . 12.1 ptmm? . . . . . 0 C--N 1.309 -1.165 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.186 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.452 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 54.3 p . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 120.9 0.381 . . . . 0.0 110.109 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.936 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.4 p90 -116.51 152.49 33.97 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.426 ' CE2' ' HD3' ' A' ' 24' ' ' LYS . 69.4 m-85 -89.42 131.8 35.3 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.445 -175.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.517 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.8 t -122.33 155.85 27.25 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 176.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.405 ' HB2' HD11 ' A' ' 20' ' ' LEU . 5.1 pm0 -129.46 107.3 9.38 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 163.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -115.04 140.07 38.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.477 -176.77 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 . . . . . 0 C--N 1.314 -0.975 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.863 -179.457 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 10' ' ' GLN . 58.9 tp . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.362 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.5 HG22 HG23 ' A' ' 23' ' ' ILE . 20.7 m -112.1 107.94 17.05 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.506 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.3 t -86.43 111.06 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.5 HG23 HG22 ' A' ' 21' ' ' THR . 9.9 pt -125.34 119.09 54.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.957 0.408 . . . . 0.0 111.779 -176.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HD3' ' CE2' ' A' ' 8' ' ' PHE . 21.3 ttpp -79.8 118.51 21.65 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.59 161.84 56.67 Favored Pre-proline 0 C--N 1.318 -0.801 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.665 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 7.5 Cg_exo -62.75 142.51 89.35 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 121.915 1.743 . . . . 0.0 111.907 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.936 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 46.4 mtp180 -63.51 -1.2 1.11 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.49 0.662 . . . . 0.0 110.015 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.4 m -107.9 -11.71 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.204 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.665 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 2.9 m -54.69 124.04 15.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.729 0.776 . . . . 0.0 112.826 176.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.627 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -98.33 177.47 5.36 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.545 171.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.35 -51.43 26.27 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.44 0.462 . . . . 0.0 111.362 -172.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -31.59 72.89 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.081 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -42.95 43.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 110.152 -176.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.52 ' CG1' HG21 ' A' ' 88' ' ' VAL . 1.3 p -72.5 -29.2 30.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.696 176.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.566 HD12 ' HB3' ' A' ' 57' ' ' TYR . 5.9 mm -56.51 -57.33 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 171.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.497 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 26.7 tt0 -64.5 -31.43 72.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.934 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 34' ' ' VAL . 6.2 tp60 -63.44 -40.79 98.09 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.145 0.498 . . . . 0.0 109.765 175.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 m -67.92 -32.09 72.3 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.693 175.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.8 mp -61.61 -33.75 74.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.189 0.519 . . . . 0.0 110.727 173.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.6 m -68.9 -39.4 79.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.063 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.488 ' HG3' HG22 ' A' ' 23' ' ' ILE . 74.5 mmtt -78.74 -49.81 12.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.876 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.53 0 CA-C-O 121.716 0.769 . . . . 0.0 109.657 176.251 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.695 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.017 0.437 . . . . 0.0 111.085 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.566 ' HB3' HD12 ' A' ' 35' ' ' ILE . 15.9 m-85 -106.31 130.53 54.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.181 -175.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.544 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -113.08 165.57 7.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 168.017 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 101' ' ' PHE . 17.6 tp -118.56 138.38 52.59 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.608 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.4 mm? -98.72 126.55 44.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.792 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.682 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.6 pt-20 -88.81 84.35 6.67 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.621 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 12.7 tt0 -85.77 123.37 31.08 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 119.477 -0.889 . . . . 0.0 108.798 175.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.608 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.01 108.82 25.9 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.738 0.78 . . . . 0.0 110.327 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 78.9 t . . . . . 0 C--N 1.322 -0.594 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.558 -173.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.7 p . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -109.62 100.67 9.68 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.56 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.8 tt0 -95.05 131.27 41.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -134.35 129.89 36.13 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.576 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -85.86 136.47 22.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.269 -173.936 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.559 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 22.3 mt -93.63 151.8 19.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.501 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.482 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 7.1 mp -80.2 167.03 20.83 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 163.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -54.63 -31.86 57.99 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.495 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 9.2 pt20 -122.13 39.84 3.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.559 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 8.1 mm-40 -76.92 -7.51 55.69 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.262 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.706 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 12.7 t 70.21 130.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 0.0 111.333 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.627 ' H ' ' HA ' ' A' ' 30' ' ' THR . 93.8 t -78.58 -46.89 24.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 CA-C-O 121.344 0.592 . . . . 0.0 109.768 178.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -72.55 -41.37 65.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.557 -175.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.706 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 6.9 mm100 -63.65 -43.61 96.25 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.345 175.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.88 -49.3 77.18 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.866 0.365 . . . . 0.0 110.436 175.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -57.64 -35.39 70.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.291 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -78.42 -5.96 53.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.012 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.706 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 73.1 mmtt -95.5 -12.64 25.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.227 0.536 . . . . 0.0 110.368 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.454 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 27.2 m0 -57.28 140.21 50.62 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -169.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.608 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.7 mppt? -102.23 38.9 1.58 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.766 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 155.12 -175.5 33.09 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.93 -177.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.557 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.43 108.76 21.31 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.985 0.392 . . . . 0.0 110.168 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -113.46 -150.32 10.54 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.425 -177.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.453 ' HB2' ' HE2' ' A' ' 100' ' ' LYS . 27.8 mtmm -150.25 139.29 21.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.635 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 97.9 m-85 -83.23 146.49 28.55 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.753 -0.779 . . . . 0.0 108.971 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.608 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 80.1 mt -136.23 127.23 42.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 O-C-N 122.182 -0.324 . . . . 0.0 111.376 -172.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.522 ' HG ' HD13 ' A' ' 35' ' ' ILE . 4.7 mp -79.28 109.8 13.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.16 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 58' ' ' VAL . 33.6 ttpt -139.67 136.93 34.78 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 176.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.56 HD21 ' CE1' ' A' ' 57' ' ' TYR . 18.5 mt -69.17 142.64 54.26 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.461 0.648 . . . . 0.0 112.507 -171.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.4 ptmm? . . . . . 0 C--N 1.314 -0.953 0 CA-C-N 114.427 -1.261 . . . . 0.0 110.084 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m . . . . . 0 N--CA 1.447 -0.612 0 CA-C-O 121.664 0.745 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.863 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 16.5 p90 -115.78 149.84 37.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.598 -1.183 . . . . 0.0 107.896 176.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -82.73 119.8 24.78 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.563 -173.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.609 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.7 t -108.72 130.98 60.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.652 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.456 ' HG2' HG22 ' A' ' 22' ' ' VAL . 45.9 mt-30 -104.15 109.01 20.65 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 164.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.637 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.5 p -129.23 121.65 54.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.066 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.613 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 91.1 m-70 . . . . . 0 C--N 1.318 -0.767 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.039 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.577 ' HA ' ' HA ' ' A' ' 12' ' ' HIS . 64.6 tp . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 120.738 0.304 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.5 m -94.81 124.89 39.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.528 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.456 HG22 ' HG2' ' A' ' 10' ' ' GLN . 46.8 t -102.86 112.92 38.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 171.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.609 HG13 ' HB ' ' A' ' 9' ' ' VAL . 3.1 pt -128.3 168.25 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.132 0.492 . . . . 0.0 111.626 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -117.85 96.98 5.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.69 157.65 33.33 Favored Pre-proline 0 CA--C 1.499 -0.998 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.736 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.9 Cg_exo -63.7 140.48 74.67 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 121.587 1.525 . . . . 0.0 111.436 -174.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.863 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 59.4 mtp180 -62.88 -0.74 0.72 Allowed 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 121.296 0.569 . . . . 0.0 110.421 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' A' ' 26' ' ' PRO . 32.9 m -114.57 -7.16 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.763 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.736 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -59.48 135.07 57.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.124 0.487 . . . . 0.0 110.707 177.061 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 9.7 p -99.62 -168.29 1.58 Allowed 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.453 ' HA ' ' CG1' ' A' ' 88' ' ' VAL . . . -60.54 -50.28 74.19 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.922 -176.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.653 ' HG2' ' HB2' ' A' ' 84' ' ' ASP . 2.2 mm-40 -59.03 -30.97 68.42 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -73.75 -52.89 11.68 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.931 0.872 . . . . 0.0 109.824 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.427 HG11 HG11 ' A' ' 88' ' ' VAL . 6.8 p -66.11 -28.14 42.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.679 -1.6 . . . . 0.0 110.3 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.499 HD13 ' HG ' ' A' ' 103' ' ' LEU . 2.3 mm -55.87 -56.21 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.389 171.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.51 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 40.9 mt-30 -64.33 -32.22 73.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.183 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -61.27 -39.02 88.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.049 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.3 m -67.88 -38.81 83.49 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.977 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -55.56 -38.6 69.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.639 174.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.64 -45.62 89.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.133 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -70.8 -35.65 72.63 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.787 0.327 . . . . 0.0 110.942 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.683 -178.304 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 27.2 m-20 . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.282 0.563 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.565 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 42.1 m-85 -118.02 139.01 51.81 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.168 -174.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.718 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -104.99 178.9 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 162.062 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.582 ' HB3' HD12 ' A' ' 82' ' ' LEU . 21.0 tp -134.83 145.71 48.58 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.696 ' O ' ' HA ' ' A' ' 101' ' ' PHE . 2.6 mm? -102.05 126.92 49.11 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.622 ' HG2' ' HB3' ' A' ' 80' ' ' ARG . 11.2 pt-20 -92.32 83.75 5.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.491 1.139 . . . . 0.0 108.202 169.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.627 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -86.7 125.42 33.87 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.501 -0.75 . . . . 0.0 110.082 176.478 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.601 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.9 OUTLIER -117.54 111.33 34.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.28 0.562 . . . . 0.0 110.364 175.176 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.556 HG23 ' OE2' ' A' ' 62' ' ' GLU . 88.9 t . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.577 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.52 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 15.0 m . . . . . 0 C--O 1.235 0.331 0 CA-C-O 121.455 0.645 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -89.85 99.87 12.8 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.483 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.598 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 48.8 tt0 -94.36 131.57 39.87 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.622 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 50.2 ttt180 -127.44 149.73 49.96 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.576 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -111.86 135.07 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 118.959 0.799 . . . . 0.0 111.498 -175.627 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.582 HD12 ' HB3' ' A' ' 59' ' ' LEU . 35.2 mt -89.99 -161.58 0.8 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.802 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.464 ' HB3' ' OE2' ' A' ' 86' ' ' GLU . 37.0 tp -131.93 -51.68 0.97 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.839 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.653 ' HB2' ' HG2' ' A' ' 32' ' ' GLN . 17.7 p-10 177.34 -38.36 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.41 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.426 ' HG3' ' CG ' ' A' ' 84' ' ' ASP . 40.9 mt-30 -118.3 19.22 13.52 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -174.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.464 ' OE2' ' HB3' ' A' ' 83' ' ' LEU . 9.0 mp0 -62.69 -6.63 3.76 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -177.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.474 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 90.4 m 67.84 96.26 0.06 Allowed 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.531 0.52 . . . . 0.0 110.018 -176.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 31' ' ' ALA . 17.9 m -68.92 -27.21 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.282 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -71.42 -39.25 71.19 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.137 -1.025 . . . . 0.0 108.991 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 39.2 mm-40 -68.05 -43.33 78.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.576 176.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.7 79.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.455 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.9 -30.89 69.33 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.089 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.3 t -77.67 -19.67 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.514 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 31.5 mmtp -75.23 -23.86 57.61 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.956 0.407 . . . . 0.0 110.367 177.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.3 m0 -58.92 158.34 8.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -171.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.425 ' H ' HG21 ' A' ' 63' ' ' VAL . 11.6 mptt -131.03 23.13 4.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 113.815 -1.539 . . . . 0.0 109.376 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -169.04 174.29 43.54 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -93.77 98.33 11.02 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 117.458 0.629 . . . . 0.0 110.99 -177.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.645 ' O ' ' HG3' ' A' ' 100' ' ' LYS . . . -106.53 -152.54 19.46 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.784 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 10.1 mtmm -156.39 149.63 24.35 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.696 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 94.4 m-85 -82.9 151.02 26.14 Favored 'General case' 0 C--N 1.312 -1.03 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.163 169.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.521 HG13 ' HB2' ' A' ' 12' ' ' HIS . 4.4 mp -130.58 125.56 59.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 121.959 -0.463 . . . . 0.0 110.62 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.499 ' HG ' HD13 ' A' ' 35' ' ' ILE . 1.9 mp -71.05 131.2 43.28 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -154.99 170.15 22.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.3 mp -96.15 145.18 25.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.493 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.718 ' HB3' HG13 ' A' ' 58' ' ' VAL . 15.7 ptpt . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.935 0.874 . . . . 0.0 110.043 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.446 -0.626 0 CA-C-O 121.322 0.582 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.862 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.0 p90 -105.91 154.73 20.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -84.9 128.67 34.72 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.162 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.498 HG22 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -122.17 128.89 75.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.072 175.005 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.463 ' HB3' HD22 ' A' ' 20' ' ' LEU . 47.1 mt-30 -100.65 106.01 17.43 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 165.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.658 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -115.69 112.49 39.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.301 -169.979 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.452 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 21.5 m-70 . . . . . 0 C--N 1.32 -0.71 0 CA-C-O 121.156 0.503 . . . . 0.0 112.169 -173.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.561 HD11 ' HD3' ' A' ' 100' ' ' LYS . 5.7 mt . . . . . 0 CA--C 1.512 -0.519 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.438 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 18.8 m -93.52 108.56 20.24 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.424 175.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.5 p -92.51 119.61 40.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.438 0.637 . . . . 0.0 110.569 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 24.5 pt -128.78 144.13 39.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.345 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -98.32 95.39 7.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 170.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.63 165.17 14.21 Favored Pre-proline 0 CA--C 1.506 -0.744 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.701 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.643 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 6.1 Cg_exo -68.65 139.89 45.57 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 122.015 1.81 . . . . 0.0 112.129 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.862 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.8 mtp180 -61.76 -8.66 5.03 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.1 m -99.09 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.604 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.643 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 15.9 m -60.87 120.43 10.15 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.433 0.635 . . . . 0.0 111.5 174.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.524 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -100.0 179.07 4.61 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.35 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.624 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.2 -52.44 20.88 Favored 'General case' 0 C--O 1.216 -0.684 0 O-C-N 123.592 0.557 . . . . 0.0 111.697 -170.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.86 -31.88 73.21 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -177.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.78 -50.34 21.05 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.8 0.81 . . . . 0.0 109.678 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.636 HG11 HD22 ' A' ' 59' ' ' LEU . 1.4 p -66.6 -27.9 41.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.442 179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 31' ' ' ALA . 5.6 mm -56.23 -57.55 8.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.078 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.554 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 41.8 tt0 -67.26 -35.1 78.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -178.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -59.47 -43.6 93.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 120.892 0.377 . . . . 0.0 110.657 175.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.3 m -71.16 -31.63 67.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.046 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 4.8 mp -55.91 -39.61 71.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.198 0.523 . . . . 0.0 110.384 171.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.3 m -72.61 -29.7 63.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.012 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -75.08 -41.1 59.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.401 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.375 0.607 . . . . 0.0 110.509 176.507 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 79.1 m-20 . . . . . 0 CA--C 1.517 -0.299 0 CA-C-O 121.305 0.574 . . . . 0.0 109.701 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.588 ' HB3' HD12 ' A' ' 35' ' ' ILE . 33.4 m-85 -108.26 154.97 21.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.753 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.72 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.25 155.6 37.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 169.439 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.636 HD22 HG11 ' A' ' 34' ' ' VAL . 22.8 tp -103.1 146.75 27.91 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.991 0.425 . . . . 0.0 110.009 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' A' ' 81' ' ' VAL . 2.1 mm? -106.81 125.45 51.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.881 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.651 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.6 pt-20 -87.76 82.67 7.29 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.3 1.048 . . . . 0.0 108.271 170.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.552 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -87.4 123.55 32.47 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 121.555 -0.716 . . . . 0.0 109.7 176.663 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.736 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.3 OUTLIER -119.39 118.11 56.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.107 178.801 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.587 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 63.3 t . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.396 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.587 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 13.4 p . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 120.912 0.387 . . . . 0.0 110.75 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.8 m -111.21 107.25 16.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.538 ' HG2' HD12 ' A' ' 60' ' ' LEU . 51.8 tt0 -93.8 131.03 39.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.88 0.371 . . . . 0.0 110.18 -172.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.519 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 55.2 ttt180 -128.01 151.62 48.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.36 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.601 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -106.18 144.28 15.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.99 -178.584 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.632 HD21 ' HB3' ' A' ' 61' ' ' GLU . 22.4 mt -101.71 150.88 22.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.566 -175.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 2.8 mm? -88.72 -173.49 4.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.151 170.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.23 -50.69 70.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 111.238 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -116.14 40.12 2.92 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.645 -177.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.463 ' HB2' ' H ' ' A' ' 83' ' ' LEU . 30.2 tp10 -76.1 -11.37 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 175.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 67.1 m 65.0 126.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 114.6 -1.182 . . . . 0.0 112.623 172.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.524 ' H ' ' HA ' ' A' ' 30' ' ' THR . 64.6 t -76.03 -42.26 38.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.559 -174.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -72.26 -38.61 68.8 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.635 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -62.06 -42.1 98.84 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.87 174.822 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.529 ' HA ' ' CE ' ' A' ' 94' ' ' LYS . . . -60.5 -43.95 96.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.638 176.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -61.17 -31.75 71.49 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.546 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.1 t -77.12 -13.84 59.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.111 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 64.4 mttt -85.1 -18.27 34.78 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.493 0.663 . . . . 0.0 110.285 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.503 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.9 m0 -62.32 145.79 52.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.355 -170.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.736 ' H ' HG21 ' A' ' 63' ' ' VAL . 20.5 mttp -115.41 23.8 12.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.754 -1.566 . . . . 0.0 108.169 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 175.89 -171.44 44.49 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-N 114.072 -1.422 . . . . 0.0 110.227 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.11 108.56 20.01 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 117.304 0.552 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.572 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -114.85 -151.02 10.05 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.829 -177.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.561 ' HD3' HD11 ' A' ' 20' ' ' LEU . 1.1 mtmp? -150.46 149.56 30.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.658 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -91.2 124.08 35.14 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.874 168.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.0 mp -111.5 129.44 66.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.304 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.567 ' HG ' HD13 ' A' ' 35' ' ' ILE . 3.8 mp -77.98 131.08 37.24 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.892 175.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.559 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.0 ttmm -145.87 -177.1 5.41 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 4.7 mp -106.57 135.71 47.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.92 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.72 ' HB3' HG13 ' A' ' 58' ' ' VAL . 16.5 ptmt . . . . . 0 C--N 1.312 -1.037 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.344 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.614 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 7.9 p . . . . . 0 N--CA 1.444 -0.736 0 CA-C-O 121.088 0.471 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.771 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 18.0 p90 -107.26 148.3 29.13 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -79.59 131.7 36.08 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.758 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.49 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.9 t -122.81 142.64 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.571 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.427 ' HB3' HD11 ' A' ' 20' ' ' LEU . 46.5 mt-30 -111.56 107.07 16.11 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 167.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.528 ' HB ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -122.63 139.65 48.86 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -175.917 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.693 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 92.5 m-70 . . . . . 0 C--N 1.314 -0.971 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.951 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.427 HD11 ' HB3' ' A' ' 10' ' ' GLN . 64.8 tp . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.26 108.76 7.24 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.489 -179.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.25 123.07 47.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 121.981 -0.449 . . . . 0.0 109.925 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.3 pt -130.36 175.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.147 0.499 . . . . 0.0 110.776 -178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 44.0 tttp -132.06 96.98 4.03 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 171.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.91 158.21 32.23 Favored Pre-proline 0 CA--C 1.5 -0.948 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.527 -176.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.712 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 8.1 Cg_exo -61.59 141.76 92.4 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.93 1.753 . . . . 0.0 111.625 -174.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.771 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.6 mtp-105 -61.79 -2.36 0.82 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.872 0.844 . . . . 0.0 110.235 -179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' A' ' 26' ' ' PRO . 3.4 p -107.67 -21.95 5.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.413 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.712 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 98.8 p -56.18 127.76 32.28 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 120.93 0.395 . . . . 0.0 110.353 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.495 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 7.7 p -95.27 -166.51 1.47 Allowed 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.477 ' HB2' HD13 ' A' ' 82' ' ' LEU . . . -59.26 -50.05 75.5 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.042 -177.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -60.72 -31.83 71.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 -178.067 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -73.29 -53.16 11.52 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 122.128 0.966 . . . . 0.0 109.797 -176.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.562 HG11 HG11 ' A' ' 88' ' ' VAL . 5.4 p -65.96 -27.96 42.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 113.771 -1.558 . . . . 0.0 110.29 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.548 HD12 ' HB3' ' A' ' 57' ' ' TYR . 4.3 mm -56.42 -56.52 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.134 170.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 34.6 tt0 -69.63 -33.4 72.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.384 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -62.03 -36.11 80.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.012 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.2 m -69.33 -37.3 77.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.899 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 7.4 mp -53.65 -44.21 69.41 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.157 0.503 . . . . 0.0 110.101 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.39 -36.19 82.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.08 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.34 -12.01 58.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.755 0.312 . . . . 0.0 111.56 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.547 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 m-20 . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.601 0.239 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.548 ' HB3' HD12 ' A' ' 35' ' ' ILE . 35.4 m-85 -103.56 145.82 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.829 -171.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.602 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -135.33 151.98 31.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.608 165.166 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.824 HD21 ' HB3' ' A' ' 101' ' ' PHE . 32.5 tp -104.51 147.17 27.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.041 0.448 . . . . 0.0 111.274 -174.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.573 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -102.84 124.9 49.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.732 176.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.667 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.5 pt-20 -88.82 87.31 7.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.232 1.015 . . . . 0.0 108.569 170.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.662 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 1.3 tt0 -85.86 124.47 32.37 Favored 'General case' 0 N--CA 1.426 -1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 109.685 175.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.57 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -118.18 113.8 43.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-O 121.188 0.518 . . . . 0.0 110.159 175.757 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.576 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.593 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.576 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.2 p . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.7 m -86.51 101.0 12.78 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.525 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.597 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 33.2 tt0 -93.91 129.86 40.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.86 -175.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.474 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 38.5 ttt-85 -125.84 147.38 49.46 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.573 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -101.65 143.24 14.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.362 178.89 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.563 HD22 ' HB3' ' A' ' 86' ' ' GLU . 45.3 mt -98.57 162.96 12.86 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.609 -176.128 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.588 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 58.6 mt -84.65 174.68 9.76 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 166.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.428 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 11.3 m-20 -55.05 -44.24 74.55 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.911 0.386 . . . . 0.0 110.546 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -121.35 53.36 1.17 Allowed 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.629 0.252 . . . . 0.0 111.374 176.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.588 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.2 OUTLIER -75.04 -4.29 37.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.559 174.283 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.495 ' HA ' ' HB ' ' A' ' 30' ' ' THR . 47.1 m 64.39 105.72 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.179 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.563 HG11 HD23 ' A' ' 59' ' ' LEU . 17.9 m -74.39 -27.37 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 O-C-N 122.311 -0.243 . . . . 0.0 111.585 -178.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -70.82 -38.58 73.27 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.459 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -63.65 -48.28 77.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.074 175.604 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.52 -50.51 67.69 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.401 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.502 ' OE1' ' HE2' ' A' ' 7' ' ' PHE . 20.8 tt0 -63.63 -37.18 86.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.707 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.4 p -75.4 -10.36 59.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.532 0.682 . . . . 0.0 110.263 176.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -101.94 -0.43 33.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.646 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.441 ' C ' ' HD3' ' A' ' 96' ' ' LYS . 40.3 m0 -75.62 158.42 32.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 122.131 0.967 . . . . 0.0 112.78 175.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.518 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.8 mppt? -126.94 29.87 5.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 113.466 -1.697 . . . . 0.0 109.228 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -175.36 -153.01 9.81 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.887 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -121.22 104.39 9.7 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.825 0.345 . . . . 0.0 110.248 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.662 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -114.56 -154.46 10.9 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.075 -1.059 . . . . 0.0 113.112 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.693 ' HD2' ' NE2' ' A' ' 12' ' ' HIS . 4.8 mtmp? -151.77 137.3 17.75 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.352 0.661 . . . . 0.0 109.76 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.824 ' HB3' HD21 ' A' ' 59' ' ' LEU . 92.3 m-85 -81.21 119.56 23.77 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.878 174.168 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 58.2 mt -110.26 120.16 60.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 O-C-N 121.993 -0.442 . . . . 0.0 111.122 -172.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.651 HD12 HD13 ' A' ' 59' ' ' LEU . 1.6 mp -71.08 128.55 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.394 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.512 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 18.3 ttmm -144.71 -177.76 5.67 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 175.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.512 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 38.7 mt -110.05 149.61 29.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.641 0.734 . . . . 0.0 111.852 -179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 19.0 ptmt . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.136 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.563 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 9.8 p . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 121.073 0.463 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.91 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.6 p90 -104.75 154.03 20.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -83.95 137.95 33.38 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.65 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.582 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.1 t -128.23 139.52 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.828 0.347 . . . . 0.0 110.265 176.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -107.58 106.29 16.57 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 165.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.69 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -116.45 134.38 60.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.698 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 . . . . . 0 C--N 1.312 -1.057 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.96 -178.048 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -92.14 109.94 21.31 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.336 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.9 p -91.82 112.74 26.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.782 0.801 . . . . 0.0 110.553 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.414 HG13 ' HB ' ' A' ' 9' ' ' VAL . 6.8 pt -121.17 171.19 10.2 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.741 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 41.5 tttp -129.25 96.12 4.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 172.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.22 161.57 22.5 Favored Pre-proline 0 CA--C 1.507 -0.706 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.324 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.956 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.9 Cg_exo -64.91 143.35 79.15 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 121.779 1.653 . . . . 0.0 111.817 -172.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.91 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 58.5 mtp85 -63.23 -1.68 1.13 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.317 0.579 . . . . 0.0 110.48 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.442 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.6 m -118.69 -0.88 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.524 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.956 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 84.4 p -59.89 139.09 57.61 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.132 0.491 . . . . 0.0 110.846 175.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.551 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -107.35 179.22 4.31 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.523 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.99 -48.97 61.22 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 123.206 0.316 . . . . 0.0 111.495 -175.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.431 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -59.65 -32.54 70.55 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.539 0.209 . . . . 0.0 110.911 -179.177 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.66 -54.18 9.75 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.059 0.933 . . . . 0.0 109.973 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.566 ' CG1' HD22 ' A' ' 59' ' ' LEU . 9.8 p -64.57 -27.34 42.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.748 -1.569 . . . . 0.0 109.849 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.647 HD13 HD12 ' A' ' 103' ' ' LEU . 6.1 mm -56.97 -56.15 16.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.066 167.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.9 tm0? -67.2 -34.64 77.93 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.791 -175.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -65.53 -48.95 70.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.477 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.456 ' HB ' HD13 ' A' ' 103' ' ' LEU . 20.6 m -63.68 -39.25 93.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.331 0.586 . . . . 0.0 110.14 178.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.45 -43.81 93.1 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.716 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.9 t -62.39 -33.98 75.82 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.734 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -75.33 -43.45 50.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.815 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.444 -177.678 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.593 ' C ' ' HG2' ' A' ' 106' ' ' LYS . 4.1 m-20 . . . . . 0 N--CA 1.448 -0.533 0 CA-C-O 121.324 0.583 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.672 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 31.7 m-85 -115.17 166.0 12.31 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.96 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.817 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -142.85 171.41 9.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.578 171.432 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.777 HD21 ' HB3' ' A' ' 101' ' ' PHE . 9.7 tp -124.0 145.48 49.17 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.7 mm? -98.78 130.34 45.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.631 179.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.604 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.7 pt-20 -95.55 84.92 4.05 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.404 1.097 . . . . 0.0 108.613 170.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.657 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 15.2 tt0 -85.62 124.23 31.93 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 121.465 -0.772 . . . . 0.0 108.961 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.522 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -114.46 110.09 30.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.14 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.514 HG23 ' HA2' ' A' ' 99' ' ' GLY . 61.3 t . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.721 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.455 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.6 m . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 m -82.23 99.53 9.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.562 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 25.8 tt0 -95.44 131.98 41.01 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 -174.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.478 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 21.7 tpp85 -129.1 159.98 34.28 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.671 HG13 HD13 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -118.21 145.77 23.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 118.442 0.565 . . . . 0.0 111.149 -175.669 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.453 HD12 ' HB3' ' A' ' 59' ' ' LEU . 42.4 mt -101.62 177.22 4.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.918 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' ASP . 30.4 tp -113.98 -49.39 2.86 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.929 0.492 . . . . 0.0 110.408 -175.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LEU . 3.5 p-10 178.46 -45.79 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.664 172.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.509 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 16.1 pt20 -117.35 34.65 5.02 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.0 mp0 -65.73 -14.78 61.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.863 -0.153 . . . . 0.0 111.213 173.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 68.2 m 66.88 104.87 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.558 0 O-C-N 123.795 0.684 . . . . 0.0 110.131 -174.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.551 ' H ' ' HA ' ' A' ' 30' ' ' THR . 15.2 m -74.79 -30.76 24.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -173.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -72.63 -37.86 67.91 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.554 -0.858 . . . . 0.0 108.804 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.685 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 57.7 mm-40 -65.02 -43.54 92.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.913 173.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.48 88.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 0.0 110.223 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 88' ' ' VAL . 5.0 tt0 -57.94 -42.29 84.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.57 -177.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.5 p -72.84 -12.53 61.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.679 -177.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.685 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 70.0 mmtt -87.25 -16.32 35.56 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.196 0.522 . . . . 0.0 110.823 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.4 m0 -60.73 157.9 13.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.438 -176.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.438 ' H ' HG21 ' A' ' 63' ' ' VAL . 25.0 mtmm -129.85 28.3 5.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.725 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.486 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -178.22 159.02 24.23 Favored Glycine 0 N--CA 1.442 -0.941 0 CA-C-N 113.802 -1.544 . . . . 0.0 109.644 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.486 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -81.62 106.8 13.86 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 117.504 0.652 . . . . 0.0 110.684 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.657 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -110.47 -151.96 13.05 Favored Glycine 0 N--CA 1.434 -1.471 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.033 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.443 ' HG3' ' C ' ' A' ' 99' ' ' GLY . 8.2 mtmt -149.79 144.2 25.86 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.777 ' HB3' HD21 ' A' ' 59' ' ' LEU . 86.2 m-85 -82.11 152.55 26.5 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.315 169.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.81 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 76.2 mt -138.67 126.4 27.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.176 -0.327 . . . . 0.0 111.072 -174.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.647 HD12 HD13 ' A' ' 35' ' ' ILE . 4.7 tp -75.57 134.63 40.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.56 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 8.4 tppt? -150.52 176.32 11.07 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.672 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.3 tp -103.69 139.19 39.29 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.817 ' HB3' HG13 ' A' ' 58' ' ' VAL . 17.5 ptmt . . . . . 0 C--N 1.322 -0.616 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.009 -174.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.467 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 49.8 p . . . . . 0 N--CA 1.445 -0.677 0 CA-C-O 121.117 0.484 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.809 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.8 p90 -135.15 147.02 49.33 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -85.68 137.06 33.09 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.113 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.522 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.2 t -123.43 142.65 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.078 0.466 . . . . 0.0 110.477 176.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.482 ' HB3' HD11 ' A' ' 20' ' ' LEU . 38.9 mt-30 -110.62 107.38 16.95 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 166.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -123.18 139.11 50.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -177.652 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.487 ' HB2' HG12 ' A' ' 102' ' ' ILE . 10.5 m-70 . . . . . 0 C--N 1.315 -0.934 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.736 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 10' ' ' GLN . 65.4 tp . . . . . 0 N--CA 1.446 -0.661 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.423 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 8.3 m -70.33 109.2 4.58 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.666 -177.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.0 121.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 pt -129.71 164.3 32.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.745 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 28.7 tttp -118.14 105.27 11.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB1' ' HD2' ' A' ' 26' ' ' PRO . . . -112.03 169.24 6.55 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.22 -174.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.724 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.3 Cg_endo -75.43 141.02 24.97 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 122.147 1.898 . . . . 0.0 111.993 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.809 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.7 mtp-105 -61.8 -6.17 2.5 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 122.147 0.975 . . . . 0.0 110.166 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.437 ' CG1' ' HB2' ' A' ' 26' ' ' PRO . 3.0 p -103.97 -20.52 5.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.194 -178.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.724 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 95.1 p -58.04 126.59 28.13 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 120.851 0.357 . . . . 0.0 110.08 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.443 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 28.4 p -94.78 -164.78 1.21 Allowed 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.529 ' HB2' HD13 ' A' ' 82' ' ' LEU . . . -61.94 -50.18 73.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.83 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -59.59 -33.95 72.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.102 0.477 . . . . 0.0 110.48 -179.196 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -69.26 -53.26 20.75 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 122.163 0.982 . . . . 0.0 109.599 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.461 ' CG1' HD22 ' A' ' 59' ' ' LEU . 5.6 p -68.84 -28.24 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 CA-C-N 113.352 -1.749 . . . . 0.0 110.357 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.705 HD13 ' HG ' ' A' ' 103' ' ' LEU . 3.8 mm -57.16 -57.77 8.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.366 171.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.571 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 33.2 tt0 -68.06 -33.61 74.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.003 -175.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -59.29 -42.64 91.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.2 m -70.14 -37.04 75.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.917 176.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 3.5 mp -52.59 -47.45 66.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.327 0.584 . . . . 0.0 110.59 172.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 16.1 t -69.97 -29.28 66.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.212 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -81.88 -30.19 32.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.808 -176.489 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 11.7 m-20 . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 120.972 0.415 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.56 ' HB3' HD12 ' A' ' 35' ' ' ILE . 50.6 m-85 -101.54 145.1 29.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.653 -174.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -131.63 144.16 38.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.888 165.649 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.808 HD21 ' HB3' ' A' ' 101' ' ' PHE . 18.4 tp -97.03 142.56 28.82 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.407 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.541 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.4 mm? -98.44 129.62 45.06 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 176.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.657 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 12.4 pt-20 -93.25 87.76 5.78 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 170.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.5 tt0 -85.61 125.04 32.82 Favored 'General case' 0 N--CA 1.425 -1.694 0 O-C-N 121.045 -1.034 . . . . 0.0 109.783 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.652 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.82 112.65 39.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.322 0.582 . . . . 0.0 110.468 175.893 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.505 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.7 t . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.437 176.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 54.4 p . . . . . 0 N--CA 1.45 -0.465 0 CA-C-O 120.917 0.389 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.7 m -94.04 101.76 13.81 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.633 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.27 131.47 39.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.72 -175.118 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.506 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 33.8 ttt180 -124.63 153.85 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.541 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -109.26 130.17 62.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.552 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 31' ' ' ALA . 21.2 mt -85.83 165.65 16.67 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.515 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.509 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 75.0 mt -84.39 178.93 7.56 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 166.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 33.5 m-20 -55.22 -48.33 74.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.191 0.519 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -121.69 50.78 1.38 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.121 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.509 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -71.82 -3.96 25.19 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 174.859 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 32.6 m 66.11 104.69 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.188 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.447 HG13 ' CA ' ' A' ' 31' ' ' ALA . 23.6 m -74.45 -26.25 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.508 0 O-C-N 122.228 -0.295 . . . . 0.0 111.641 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -71.97 -35.18 69.44 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.501 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -66.32 -48.15 71.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.199 175.123 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.411 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -54.4 -48.83 71.14 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.969 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -56.94 -47.94 79.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.46 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.6 p -70.61 -6.67 38.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.448 0.642 . . . . 0.0 110.839 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 25.9 ttpp -106.66 0.25 24.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.106 -176.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.464 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -74.22 157.39 35.97 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.754 0.787 . . . . 0.0 112.906 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.652 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.6 mppt? -120.65 23.78 10.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.22 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 176.28 -175.06 47.36 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.344 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.46 104.99 16.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 117.386 0.593 . . . . 0.0 111.092 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.625 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -111.56 -145.98 10.22 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.42 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.37 145.46 13.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.225 0.61 . . . . 0.0 109.636 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.808 ' HB3' HD21 ' A' ' 59' ' ' LEU . 93.4 m-85 -79.96 140.8 36.49 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.991 175.248 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.487 HG12 ' HB2' ' A' ' 12' ' ' HIS . 70.0 mt -129.03 125.69 63.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 122.187 -0.321 . . . . 0.0 111.246 -173.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.705 ' HG ' HD13 ' A' ' 35' ' ' ILE . 6.4 mp -73.86 128.35 35.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.023 0.439 . . . . 0.0 111.219 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.508 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 21.1 ttmm -145.72 177.87 8.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 57' ' ' TYR . 18.1 mt -108.87 143.41 38.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.374 0.607 . . . . 0.0 112.041 179.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.621 ' HB3' HG13 ' A' ' 58' ' ' VAL . 18.9 ptmt . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.326 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.445 -0.679 0 CA-C-O 121.078 0.466 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.624 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 3.4 p90 -106.13 155.78 19.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -176.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -90.88 137.01 32.69 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.255 -174.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.603 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.2 t -122.49 141.0 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.625 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.579 ' HB3' HD11 ' A' ' 20' ' ' LEU . 41.8 mt-30 -111.43 109.24 19.11 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 165.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.73 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.4 p -135.83 137.9 48.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.776 0.322 . . . . 0.0 111.131 -173.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 111.195 -177.212 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.579 HD11 ' HB3' ' A' ' 10' ' ' GLN . 60.1 tp . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.59 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 25.7 m -80.14 108.92 14.12 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.197 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.44 114.92 33.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.471 0.653 . . . . 0.0 109.512 177.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.603 HG13 ' HB ' ' A' ' 9' ' ' VAL . 14.1 pt -124.77 174.15 9.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.985 -176.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -124.42 96.88 5.07 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 171.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.87 163.65 17.37 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.7 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.936 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.2 Cg_endo -70.08 144.16 51.47 Favored 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 121.925 1.75 . . . . 0.0 111.99 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.624 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 52.1 mtp180 -61.02 -8.82 3.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.394 0.616 . . . . 0.0 110.729 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -106.99 -5.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.99 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.936 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -56.2 126.64 27.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.55 0.69 . . . . 0.0 110.961 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.532 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.5 t -107.1 -179.15 3.85 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.057 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.69 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.56 -48.82 27.69 Favored 'General case' 0 C--O 1.211 -0.934 0 O-C-N 123.484 0.49 . . . . 0.0 111.822 -172.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.752 ' HA ' HD12 ' A' ' 35' ' ' ILE . 5.5 pp0? -71.46 -27.18 63.08 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.864 -177.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.83 -52.41 30.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 122.004 0.907 . . . . 0.0 108.978 176.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.45 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.38 -26.89 37.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.125 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 57' ' ' TYR . 8.4 mt -55.7 -57.55 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.261 169.358 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.0 tt0 -65.45 -32.65 74.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.831 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.467 ' HG2' HD12 ' A' ' 23' ' ' ILE . 45.5 tp60 -61.73 -45.15 95.19 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.165 0.507 . . . . 0.0 110.137 175.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.526 ' HB ' HD22 ' A' ' 103' ' ' LEU . 20.5 m -69.05 -38.39 79.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.89 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -50.65 -42.25 56.28 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.214 0.531 . . . . 0.0 110.67 171.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.36 -46.56 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.505 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -79.92 -19.91 46.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-O 120.878 0.371 . . . . 0.0 110.573 177.658 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.531 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 32.3 m-20 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.241 0.543 . . . . 0.0 111.298 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.78 ' HB2' HD13 ' A' ' 35' ' ' ILE . 11.8 m-85 -116.5 177.85 4.55 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.616 0.722 . . . . 0.0 110.63 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.42 HG22 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -148.26 -179.73 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.844 170.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.989 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -144.27 139.96 28.92 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.591 ' CD1' HG13 ' A' ' 81' ' ' VAL . 2.3 mm? -104.0 127.86 51.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.896 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.3 pt-20 -94.3 86.35 4.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.432 1.111 . . . . 0.0 108.39 167.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.557 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -86.71 123.66 32.12 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.078 175.232 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.567 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -115.64 118.33 58.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.224 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 84.4 t . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.231 0.539 . . . . 0.0 110.815 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.1 m . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 120.72 0.295 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.4 t -102.54 99.25 9.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.534 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 43.8 tt0 -94.97 132.05 40.24 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.028 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -129.22 144.09 51.09 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.591 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -103.78 141.1 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 118.71 0.686 . . . . 0.0 110.928 -178.024 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.656 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 7.8 mt -101.27 156.81 17.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.521 -176.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.6 mp -86.1 171.83 11.05 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 165.066 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.47 -31.38 55.62 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -176.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 6.9 pt20 -121.47 33.13 5.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -176.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.656 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 11.7 mm-40 -72.58 -11.74 60.77 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.559 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 55.5 m 68.08 118.61 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.403 0.621 . . . . 0.0 111.931 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.532 ' H ' ' HA ' ' A' ' 30' ' ' THR . 91.7 t -75.78 -37.08 34.76 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.864 -175.142 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -72.74 -38.78 67.28 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.559 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 18.1 mt-30 -58.36 -45.71 87.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.309 172.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.516 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.35 -50.99 70.7 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.117 178.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.446 ' OE1' ' HE2' ' A' ' 101' ' ' PHE . 12.1 tt0 -59.35 -24.97 63.81 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.674 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -82.93 -9.21 59.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.129 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 80.3 mttt -86.53 -24.18 25.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.201 0.524 . . . . 0.0 110.538 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.404 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 44.5 m0 -56.16 143.49 33.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.984 -1.007 . . . . 0.0 113.168 -168.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -124.87 20.21 8.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.255 -1.338 . . . . 0.0 108.891 177.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.509 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -168.17 155.22 25.78 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 108.526 -1.83 . . . . 0.0 108.526 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.04 103.92 11.18 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 118.08 0.94 . . . . 0.0 111.256 -176.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.567 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -109.64 -147.66 11.97 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.725 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.01 155.05 32.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.002 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.989 ' HB3' HD11 ' A' ' 59' ' ' LEU . 94.8 m-85 -85.35 151.4 24.05 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 168.53 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.582 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.5 mp -131.01 125.87 58.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 O-C-N 121.829 -0.544 . . . . 0.0 110.054 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.526 HD22 ' HB ' ' A' ' 38' ' ' THR . 25.0 tp -80.61 133.63 35.78 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -146.93 159.68 43.26 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 0.8 OUTLIER -82.89 150.77 26.3 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.634 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.2 ptmm? . . . . . 0 C--N 1.315 -0.91 0 CA-C-O 121.453 0.644 . . . . 0.0 109.307 176.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p . . . . . 0 N--CA 1.44 -0.947 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.607 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.2 p90 -132.21 152.18 51.44 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -85.86 129.76 34.74 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.023 0.439 . . . . 0.0 111.396 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.596 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.0 t -118.1 118.03 56.8 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.323 178.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.627 ' HB3' HD11 ' A' ' 20' ' ' LEU . 80.6 mt-30 -90.56 108.04 19.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 164.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.805 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -121.66 114.33 42.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 121.653 0.74 . . . . 0.0 111.135 -178.888 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.588 ' HB2' HG13 ' A' ' 102' ' ' ILE . 16.4 m80 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.905 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.627 HD11 ' HB3' ' A' ' 10' ' ' GLN . 41.0 tp . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 21.6 m -85.58 108.45 17.97 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.425 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.4 t -94.22 111.78 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 O-C-N 122.055 -0.403 . . . . 0.0 110.306 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 9' ' ' VAL . 22.5 pt -123.15 170.3 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.161 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 tttt -119.16 113.73 21.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.408 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -115.43 168.49 8.22 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.742 -176.154 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.891 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.6 Cg_endo -75.38 143.46 27.91 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.01 1.807 . . . . 0.0 111.568 -179.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.607 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 67.2 mtt180 -59.31 -18.37 37.27 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.506 0.67 . . . . 0.0 110.495 -176.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.38 -14.34 9.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.137 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.891 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.1 p -55.42 128.52 34.68 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.753 0.787 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.526 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -111.23 177.55 4.62 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.364 176.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.74 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -49.78 -52.77 29.51 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 123.642 0.589 . . . . 0.0 111.306 -171.007 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.463 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -57.17 -34.92 68.95 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.721 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.47 -52.4 10.78 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.467 0.651 . . . . 0.0 110.523 -175.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.738 HG11 HD22 ' A' ' 59' ' ' LEU . 3.3 p -62.54 -27.62 43.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.064 177.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.74 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.6 mm -56.01 -57.29 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.976 172.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.436 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 63.4 tt0 -71.82 -32.55 67.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -177.134 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -56.94 -37.77 71.99 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.04 0.448 . . . . 0.0 110.077 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.0 m -70.52 -38.5 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.965 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 9.2 mp -54.59 -43.62 72.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.851 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.2 t -71.07 -37.57 72.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.762 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -73.46 -25.43 60.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.885 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.465 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -172.553 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.526 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.2 m-20 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 120.883 0.373 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.602 ' HB3' HD12 ' A' ' 35' ' ' ILE . 61.1 m-85 -110.4 155.94 21.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 110.832 -177.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.02 146.75 21.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 170.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.781 HD21 ' HB3' ' A' ' 101' ' ' PHE . 16.1 tp -99.68 147.8 25.03 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.046 0.451 . . . . 0.0 110.803 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.621 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.4 mm? -106.1 133.34 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.594 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.676 ' HB3' HD21 ' A' ' 82' ' ' LEU . 11.8 pt-20 -94.59 85.23 4.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.706 1.241 . . . . 0.0 108.484 170.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.615 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 14.6 tt0 -86.12 122.86 30.74 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.387 -0.82 . . . . 0.0 109.262 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.538 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.9 OUTLIER -113.36 111.98 38.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-O 121.234 0.54 . . . . 0.0 110.173 176.552 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.641 HG23 ' HA2' ' A' ' 99' ' ' GLY . 79.7 t . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.177 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 57.0 m . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.531 ' HB3' HG13 ' A' ' 63' ' ' VAL . 20.7 t -80.29 99.35 7.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.25 131.26 40.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.536 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 35.6 ttt-85 -128.35 152.73 47.82 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.564 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.92 144.23 16.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.988 0.813 . . . . 0.0 110.719 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.676 HD21 ' HB3' ' A' ' 61' ' ' GLU . 16.9 mt -100.17 158.8 15.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.284 -176.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.8 mp -92.46 -179.19 5.13 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.0 -52.3 34.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.302 0.377 . . . . 0.0 111.337 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -119.52 51.59 1.15 Allowed 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.6 tp10 -73.12 -21.17 60.78 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.101 0.477 . . . . 0.0 109.738 170.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 54.9 m 73.7 124.98 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.267 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.524 ' H ' ' HA ' ' A' ' 30' ' ' THR . 89.4 t -75.05 -42.94 45.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.521 -173.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 92.9 t80 -73.02 -33.38 65.71 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.59 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 41.5 mt-30 -64.12 -41.25 97.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.568 172.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.182 0.515 . . . . 0.0 110.386 176.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -63.39 -28.66 70.14 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.643 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.8 p -78.65 -6.8 56.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.874 0.369 . . . . 0.0 110.934 178.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 34.3 mmtp -88.19 -22.04 24.24 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.302 0.573 . . . . 0.0 109.829 176.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.449 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.5 m0 -62.3 148.29 45.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.866 -173.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.538 ' H ' HG21 ' A' ' 63' ' ' VAL . 95.1 mttt -117.59 13.1 14.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.122 178.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -167.58 173.8 42.64 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.08 100.46 13.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 117.777 0.789 . . . . 0.0 111.208 -176.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.641 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -104.3 -145.11 13.91 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.997 -178.677 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.589 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -153.2 153.16 32.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 174.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.805 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.3 m-85 -87.95 122.59 31.75 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 170.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.621 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -101.19 123.61 54.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 O-C-N 121.81 -0.556 . . . . 0.0 110.444 -171.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.62 HD12 HD13 ' A' ' 35' ' ' ILE . 6.0 tp -74.99 127.19 32.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.32 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -147.03 170.25 17.53 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.1 mp -95.98 160.11 14.63 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 175.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 10.9 ptmm? . . . . . 0 C--N 1.31 -1.115 0 CA-C-O 122.11 0.957 . . . . 0.0 109.6 175.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.443 -0.804 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.713 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.3 p90 -137.74 155.04 49.5 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -177.246 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -90.21 133.74 34.73 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.063 0.459 . . . . 0.0 111.586 -174.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.587 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -119.52 121.23 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.274 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.569 ' HB3' HD11 ' A' ' 20' ' ' LEU . 95.9 mt-30 -95.56 108.45 20.7 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 166.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.77 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -125.43 123.44 64.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.393 0.616 . . . . 0.0 111.092 -175.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.56 ' HB2' HG13 ' A' ' 102' ' ' ILE . 63.2 m-70 . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.695 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 10' ' ' GLN . 58.3 tp . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 120.732 0.301 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.6 m -77.5 144.97 37.3 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 174.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.0 t -125.99 118.08 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.587 HG13 ' HB ' ' A' ' 9' ' ' VAL . 7.3 pt -127.41 169.48 18.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 tttt -120.59 104.16 9.72 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 171.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.576 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -102.35 170.02 6.87 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.792 -175.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.881 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 3.8 Cg_endo -75.75 142.65 25.89 Favored 'Trans proline' 0 N--CA 1.446 -1.321 0 C-N-CA 122.007 1.804 . . . . 0.0 111.302 178.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.713 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 77.9 mtt180 -59.89 -15.62 22.79 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.219 0.533 . . . . 0.0 110.82 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.91 -12.58 8.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.841 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.881 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.9 p -54.69 127.19 27.08 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.63 0.729 . . . . 0.0 110.829 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.578 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -107.95 -179.08 3.79 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.515 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.83 -51.52 29.07 Favored 'General case' 0 C--O 1.212 -0.897 0 O-C-N 123.579 0.549 . . . . 0.0 110.862 -172.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -37.8 69.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -70.7 -53.37 15.89 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 122.234 1.016 . . . . 0.0 109.966 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.651 HG11 HD22 ' A' ' 59' ' ' LEU . 3.0 p -66.05 -27.23 40.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 113.525 -1.67 . . . . 0.0 110.175 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.56 HD13 HD12 ' A' ' 103' ' ' LEU . 3.7 mm -56.12 -57.32 8.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.797 172.058 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.55 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 40.0 tp60 -69.25 -33.6 73.5 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.576 HE22 ' HA ' ' A' ' 25' ' ' ALA . 32.6 tt0 -60.41 -42.3 95.72 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.859 0.361 . . . . 0.0 110.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.1 m -67.34 -37.07 82.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.046 174.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -55.18 -41.9 72.5 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.131 0.491 . . . . 0.0 110.611 172.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.5 t -72.65 -34.28 67.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.886 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -74.3 -39.29 63.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.013 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.473 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -172.147 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.537 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 18.0 m-20 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 120.622 0.248 . . . . 0.0 111.574 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 43.0 m-85 -111.55 153.64 25.95 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.918 0.39 . . . . 0.0 110.738 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.58 142.69 30.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.059 169.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.651 HD22 HG11 ' A' ' 34' ' ' VAL . 15.8 tp -93.66 145.33 24.63 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.07 0.462 . . . . 0.0 110.412 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.7 mm? -107.04 129.4 54.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.831 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.671 ' HB3' HD21 ' A' ' 82' ' ' LEU . 15.4 pt-20 -91.13 85.34 5.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.565 1.174 . . . . 0.0 108.283 169.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.639 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 14.3 tt0 -86.29 123.82 31.97 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.632 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.572 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -117.77 116.29 51.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.864 175.959 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.546 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 95.6 t . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 121.675 0.75 . . . . 0.0 110.385 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 2.0 p . . . . . 0 N--CA 1.445 -0.692 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -75.82 99.03 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.221 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 40.2 tt0 -94.49 131.44 40.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -175.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.541 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 3.6 tmt_? -132.93 137.41 46.6 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.558 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -98.05 137.41 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.679 -173.911 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.71 HD22 ' HG2' ' A' ' 86' ' ' GLU . 11.7 mt -94.04 168.64 10.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.258 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 83' ' ' LEU . 6.4 mp -107.82 -174.38 2.51 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.519 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -47.13 -53.71 12.26 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.397 0.435 . . . . 0.0 111.583 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 5.7 pt20 -125.25 67.54 1.13 Allowed 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.71 ' HG2' HD22 ' A' ' 82' ' ' LEU . 16.6 tp10 -77.49 -23.97 50.21 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 165.048 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 72.0 m 75.12 121.44 0.04 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.233 -174.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.503 ' H ' ' HA ' ' A' ' 30' ' ' THR . 78.2 t -75.2 -40.15 43.49 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-O 121.203 0.525 . . . . 0.0 110.383 -172.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 87.9 t80 -73.41 -32.73 64.6 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.637 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 36.0 mt-30 -69.82 -33.49 72.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.969 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.39 -43.7 66.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.245 0.545 . . . . 0.0 110.067 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -62.24 -29.44 70.4 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.506 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.8 p -81.02 -4.91 56.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.852 0.358 . . . . 0.0 111.277 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 32.7 mmtp -85.15 -24.18 28.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.472 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.0 m0 -61.74 148.02 44.29 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.41 -169.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -127.47 19.74 6.78 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.238 -1.347 . . . . 0.0 108.818 176.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -161.07 169.93 36.78 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.59 98.8 11.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 118.047 0.923 . . . . 0.0 111.137 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.639 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -110.65 -152.1 12.89 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 119.965 -1.112 . . . . 0.0 112.109 -177.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.522 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.9 mptp? -153.81 155.03 35.06 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.77 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 94.3 m-85 -85.19 126.73 33.89 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.937 -0.705 . . . . 0.0 109.147 171.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -103.2 124.35 57.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 O-C-N 121.771 -0.581 . . . . 0.0 110.633 -175.02 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.56 HD12 HD13 ' A' ' 35' ' ' ILE . 8.4 tp -81.84 105.5 13.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 18.5 ttmm -126.09 171.37 10.89 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.5 mp -92.58 162.3 14.24 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.149 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.7 ptmm? . . . . . 0 C--N 1.313 -1.002 0 CA-C-O 121.925 0.869 . . . . 0.0 109.617 174.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.442 -0.834 0 CA-C-O 121.112 0.482 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.951 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.0 p90 -136.53 153.18 51.08 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -89.05 130.29 35.53 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.331 -175.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.541 HG22 ' CE2' ' A' ' 7' ' ' PHE . 3.3 t -114.5 131.58 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.314 178.533 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 80.4 mt-30 -100.68 108.08 19.85 Favored 'General case' 0 N--CA 1.428 -1.557 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 162.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.755 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.06 113.98 40.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.591 ' HB2' HG13 ' A' ' 102' ' ' ILE . 83.2 m-70 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.168 -177.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.597 HD11 ' HB3' ' A' ' 10' ' ' GLN . 54.3 tp . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.561 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 99.6 m -82.14 109.49 16.5 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.703 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.4 t -93.09 111.51 24.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.513 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.5 pt -124.13 175.9 6.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.053 0.454 . . . . 0.0 111.209 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.0 tttt -124.0 110.56 14.93 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -110.42 169.43 6.36 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.635 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.957 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.2 Cg_endo -74.36 142.52 30.16 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 121.608 1.539 . . . . 0.0 111.382 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.951 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.1 mtt180 -64.53 -1.44 1.79 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.175 0.512 . . . . 0.0 111.279 -175.175 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 m -112.88 -6.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.95 175.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.957 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.9 p -50.0 139.84 13.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.509 0.671 . . . . 0.0 111.717 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.559 ' CB ' ' HA ' ' A' ' 87' ' ' CYS . 4.2 t -118.33 174.05 6.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.328 174.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.58 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.7 -52.02 44.13 Favored 'General case' 0 C--O 1.213 -0.838 0 O-C-N 123.707 0.629 . . . . 0.0 111.183 -171.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.416 ' HG3' ' OD2' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -55.96 -33.81 65.11 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.564 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -76.07 -52.54 9.95 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.844 0.83 . . . . 0.0 110.46 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.594 ' CG1' HD22 ' A' ' 59' ' ' LEU . 6.0 p -64.43 -27.28 42.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 114.188 -1.369 . . . . 0.0 110.145 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.58 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.4 mm -56.46 -57.59 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.732 171.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 37.7 tp60 -66.97 -34.33 77.52 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.948 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -58.87 -43.02 90.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 120.542 0.211 . . . . 0.0 110.855 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.44 HG21 HD22 ' A' ' 103' ' ' LEU . 15.6 m -68.3 -34.69 76.6 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 35' ' ' ILE . 8.1 mp -54.6 -54.48 40.81 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.234 0.54 . . . . 0.0 110.472 172.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.63 -34.99 79.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.875 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.31 -37.35 87.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.221 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.554 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -171.902 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 1.1 m-20 . . . . . 0 CA--C 1.52 -0.198 0 CA-C-O 121.147 0.499 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 38.3 m-85 -111.51 160.84 16.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.185 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.44 137.05 36.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.914 168.049 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.628 HD21 ' HB3' ' A' ' 101' ' ' PHE . 22.4 tp -89.94 140.51 29.55 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.205 0.526 . . . . 0.0 110.561 -177.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.569 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.6 mm? -101.67 128.89 47.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.731 178.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.602 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 14.3 pt-20 -92.18 84.25 5.21 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.353 1.073 . . . . 0.0 108.302 170.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.606 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 20.1 tt0 -86.08 121.86 29.29 Favored 'General case' 0 N--CA 1.425 -1.719 0 O-C-N 120.902 -1.124 . . . . 0.0 109.506 176.536 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.538 HG13 ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -104.37 104.47 16.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.358 174.059 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 61.3 t . . . . . 0 N--CA 1.449 -0.508 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.808 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 83.7 p . . . . . 0 N--CA 1.448 -0.549 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.538 ' HB3' HG13 ' A' ' 63' ' ' VAL . 22.7 t -91.0 102.64 15.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.606 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 34.7 tt0 -95.14 131.35 41.25 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.075 0.464 . . . . 0.0 110.226 -175.119 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.572 ' HD3' ' OE2' ' A' ' 61' ' ' GLU . 32.7 ttt-85 -127.0 151.9 47.96 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.519 HG13 HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.17 140.14 27.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 118.851 0.75 . . . . 0.0 110.448 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.561 HD12 ' HB3' ' A' ' 59' ' ' LEU . 10.0 mt -93.69 165.5 12.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.551 0.691 . . . . 0.0 111.589 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.0 mp -96.12 -174.38 3.08 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.652 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.416 ' OD2' ' HG3' ' A' ' 32' ' ' GLN . 15.3 t70 -53.29 -51.11 63.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.275 0.559 . . . . 0.0 110.798 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.481 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 12.9 pt20 -125.84 55.54 1.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.574 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.0 tp10 -73.46 -23.03 60.03 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.602 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 7.5 m 76.0 132.15 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.013 -176.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.527 ' H ' ' HA ' ' A' ' 30' ' ' THR . 69.5 t -76.04 -42.81 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-O 121.176 0.512 . . . . 0.0 110.155 -174.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -73.0 -33.49 65.81 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.602 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 44.9 mt-30 -67.55 -36.79 81.65 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.157 173.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -45.35 70.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.557 0.694 . . . . 0.0 110.344 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -61.7 -32.57 72.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.816 -177.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.5 p -76.24 -16.11 59.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.648 0.261 . . . . 0.0 111.432 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 24.5 mmtp -74.67 -27.31 60.36 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.365 0.603 . . . . 0.0 110.016 176.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.41 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -55.68 144.67 26.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.765 -1.107 . . . . 0.0 113.695 -169.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -108.04 14.74 24.93 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.222 -1.354 . . . . 0.0 109.255 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.36 -166.59 30.38 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.611 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -107.46 107.97 19.08 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 117.54 0.67 . . . . 0.0 110.999 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.595 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -116.68 -147.47 8.73 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.575 -0.822 . . . . 0.0 111.777 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.652 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -152.05 160.46 43.44 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 173.697 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.755 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 85.9 m-85 -88.87 123.91 33.69 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 169.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.8 mp -103.07 121.97 54.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 121.952 -0.468 . . . . 0.0 110.188 -175.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.566 HD12 HD13 ' A' ' 35' ' ' ILE . 7.8 tp -79.31 112.07 16.18 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HE2' ' HB2' ' A' ' 104' ' ' LYS . 17.7 ttmm -131.39 168.88 16.83 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 2.1 mp -91.53 161.17 15.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 14.3 ptmm? . . . . . 0 C--N 1.312 -1.027 0 CA-C-O 121.762 0.792 . . . . 0.0 109.486 174.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB2' ' HE2' ' A' ' 24' ' ' LYS . 17.4 m . . . . . 0 N--CA 1.45 -0.473 0 CA-C-O 121.296 0.569 . . . . 0.0 109.938 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.91 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.0 p90 -114.4 157.31 23.04 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -87.95 133.73 33.87 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.002 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.546 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -118.69 129.56 74.76 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.442 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.736 ' HB3' HD11 ' A' ' 20' ' ' LEU . 79.7 mt-30 -96.97 108.03 20.67 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 163.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.724 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.88 118.95 56.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.33 0.586 . . . . 0.0 110.499 178.745 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.584 ' HB2' HG13 ' A' ' 102' ' ' ILE . 29.1 m-70 . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.935 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.736 HD11 ' HB3' ' A' ' 10' ' ' GLN . 45.0 tp . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 50.6 m -83.36 108.05 16.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.419 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 56.5 t -95.65 111.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.546 HG13 ' HB ' ' A' ' 9' ' ' VAL . 12.8 pt -120.69 175.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.0 111.323 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 6' ' ' SER . 39.8 tttt -122.87 120.15 32.64 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 170.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -126.74 167.88 16.15 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -171.342 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.907 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.2 Cg_exo -68.2 139.59 46.63 Favored 'Trans proline' 0 N--CA 1.442 -1.52 0 C-N-CA 121.293 1.329 . . . . 0.0 111.429 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.91 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 42.3 mtt180 -66.72 -0.86 3.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.233 0.539 . . . . 0.0 110.701 -177.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.2 m -112.26 -9.1 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.979 174.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.907 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.5 p -46.45 139.59 4.85 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.891 0.853 . . . . 0.0 112.724 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.554 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 4.3 t -116.35 174.74 5.89 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.264 172.216 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.711 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.19 -50.79 48.28 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 123.579 0.55 . . . . 0.0 111.576 -171.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -34.63 70.1 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.43 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.33 -52.38 16.45 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.043 0.925 . . . . 0.0 110.084 -176.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.839 HG11 HD22 ' A' ' 59' ' ' LEU . 8.0 p -65.09 -27.94 43.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.261 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.711 HG12 ' O ' ' A' ' 31' ' ' ALA . 7.2 mm -56.77 -58.97 3.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.378 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 63.1 tt0 -73.77 -32.49 63.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.509 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.7 -42.72 84.31 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 120.781 0.324 . . . . 0.0 110.156 174.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.3 m -66.32 -38.06 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.017 175.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.574 HD13 ' O ' ' A' ' 35' ' ' ILE . 7.8 mp -53.5 -44.25 68.9 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.804 173.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.1 t -63.19 -34.14 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.258 0.551 . . . . 0.0 111.026 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -80.48 -21.58 41.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.216 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -172.905 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.533 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 60.5 m-20 . . . . . 0 CA--C 1.517 -0.302 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 35' ' ' ILE . 42.2 m-85 -113.09 151.9 30.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.066 0.46 . . . . 0.0 111.1 -175.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -138.8 142.92 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.765 170.732 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.839 HD22 HG11 ' A' ' 34' ' ' VAL . 19.6 tp -94.57 142.56 27.31 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.015 0.436 . . . . 0.0 110.014 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.543 HD12 ' HG2' ' A' ' 79' ' ' GLN . 2.1 mm? -106.45 125.06 50.52 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.633 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.655 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -88.62 85.47 6.82 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 122.505 1.145 . . . . 0.0 108.351 171.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.544 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 1.8 tm-20 -87.14 121.73 29.99 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.592 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -109.51 112.4 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.464 176.184 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.651 HG23 ' HA2' ' A' ' 99' ' ' GLY . 61.1 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.343 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.519 ' HB3' HG13 ' A' ' 63' ' ' VAL . 26.9 t -82.23 100.19 9.73 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.543 ' HG2' HD12 ' A' ' 60' ' ' LEU . 7.3 tt0 -93.47 131.49 38.64 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.59 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 30.7 ttt-85 -126.35 150.44 48.55 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.541 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.48 144.21 16.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 118.979 0.809 . . . . 0.0 110.328 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.553 HD12 ' HB3' ' A' ' 59' ' ' LEU . 15.7 mt -101.62 149.64 23.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.872 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 83' ' ' LEU . 6.2 mp -83.26 172.31 12.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.599 171.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -48.02 -48.98 32.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.221 0.534 . . . . 0.0 110.983 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -119.52 38.84 3.76 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.17 -176.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.1 tp10 -71.01 -21.83 62.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.986 0.422 . . . . 0.0 109.923 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.572 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 43.8 m 76.14 125.22 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.962 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.554 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.2 t -76.39 -39.41 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.078 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -72.88 -33.93 66.36 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.572 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 42.6 mt-30 -67.11 -30.05 69.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.958 174.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.66 -42.58 50.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.342 0.591 . . . . 0.0 110.397 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -56.78 -37.67 71.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.742 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 71.7 p -72.39 -13.9 61.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.818 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -78.1 -27.73 48.49 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 110.588 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.489 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.1 m0 -55.69 139.24 45.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -166.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.403 ' H ' HG21 ' A' ' 63' ' ' VAL . 88.8 mttt -109.59 14.12 23.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.787 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.84 176.13 45.04 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.747 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.69 99.08 10.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.692 0.746 . . . . 0.0 110.857 -177.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.651 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.97 -148.8 15.32 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.963 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.7 mptp? -150.15 155.61 40.11 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.744 ' HB3' HD21 ' A' ' 59' ' ' LEU . 99.2 m-85 -84.58 120.78 26.75 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 169.03 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.584 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -102.07 127.37 55.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.846 -0.534 . . . . 0.0 110.356 -174.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.427 HD12 HD13 ' A' ' 35' ' ' ILE . 8.9 tp -81.19 120.87 25.42 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.3 ttmm -140.63 175.64 9.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.2 mp -98.47 156.47 16.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HB3' HG13 ' A' ' 58' ' ' VAL . 19.2 ptmt . . . . . 0 C--N 1.312 -1.037 0 CA-C-O 122.092 0.949 . . . . 0.0 110.245 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.444 -0.734 0 CA-C-O 121.169 0.509 . . . . 0.0 109.972 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.593 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.3 p90 -104.3 150.0 24.84 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -80.53 120.67 24.81 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.189 -174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.571 ' HB ' HG13 ' A' ' 23' ' ' ILE . 19.1 t -107.06 135.53 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.424 175.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.577 ' HB3' HD11 ' A' ' 20' ' ' LEU . 48.4 mt-30 -112.69 109.04 18.3 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 165.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.731 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -131.49 122.82 51.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.112 -175.461 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.581 ' CD2' HD13 ' A' ' 20' ' ' LEU . 42.3 m-70 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.811 -176.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.581 HD13 ' CD2' ' A' ' 12' ' ' HIS . 51.9 tp . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.8 m -75.19 109.51 8.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.278 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -94.73 115.75 34.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.571 HG13 ' HB ' ' A' ' 9' ' ' VAL . 1.6 pt -130.97 130.06 63.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.363 -177.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -84.5 96.05 9.0 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -107.28 162.15 20.69 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.336 -173.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.869 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.6 Cg_exo -65.29 144.76 81.75 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.747 1.631 . . . . 0.0 112.158 -171.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.593 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 18.7 mtp180 -60.22 -11.28 5.9 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.609 0.719 . . . . 0.0 110.214 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.87 -4.41 9.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.46 177.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.869 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.8 p -58.33 124.6 20.05 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.495 0.664 . . . . 0.0 110.777 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.56 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.7 t -106.06 177.88 4.73 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.261 172.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.708 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.63 -50.33 24.72 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 123.564 0.54 . . . . 0.0 111.938 -171.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.691 ' HA ' HD12 ' A' ' 35' ' ' ILE . 4.8 pp0? -71.44 -27.56 63.35 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.634 -176.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.88 -49.34 53.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.895 0.855 . . . . 0.0 109.158 178.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 31' ' ' ALA . 2.3 p -69.18 -27.65 35.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.941 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.752 HD13 ' HB2' ' A' ' 57' ' ' TYR . 12.2 mt -56.64 -57.69 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.459 170.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.52 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 36.3 tt0 -66.1 -32.19 73.5 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.866 -176.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -59.44 -45.91 90.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-O 121.373 0.606 . . . . 0.0 109.686 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.4 m -64.82 -39.59 93.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.081 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.2 mp -50.79 -43.79 58.77 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.063 0.459 . . . . 0.0 110.828 173.446 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 86.0 m -63.46 -43.95 95.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.749 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -79.64 -16.41 55.83 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.582 0 CA-C-O 120.503 0.192 . . . . 0.0 111.089 179.3 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.522 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.0 m-20 . . . . . 0 N--CA 1.463 0.224 0 CA-C-O 121.117 0.484 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.752 ' HB2' HD13 ' A' ' 35' ' ' ILE . 16.4 m-85 -104.54 175.32 5.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.352 0.596 . . . . 0.0 110.189 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.505 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -144.28 180.0 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.339 169.838 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 1.081 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.7 tm? -144.19 137.51 27.45 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 -176.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.639 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.49 127.33 46.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.82 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.609 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.2 pt-20 -93.21 84.24 4.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.476 1.132 . . . . 0.0 108.549 169.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.627 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 7.3 tt0 -86.0 123.35 31.23 Favored 'General case' 0 N--CA 1.426 -1.659 0 O-C-N 121.624 -0.672 . . . . 0.0 109.956 176.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.527 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -113.77 116.13 51.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.086 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.647 HG23 ' HA2' ' A' ' 99' ' ' GLY . 97.4 t . . . . . 0 C--N 1.325 -0.47 0 CA-C-O 121.29 0.567 . . . . 0.0 110.601 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 50.4 m . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.711 0.291 . . . . 0.0 110.771 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.9 t -87.27 98.66 11.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.627 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 49.5 tt0 -97.7 131.67 44.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.726 -174.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.536 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 2.3 tmt_? -128.04 148.7 50.56 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.539 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.63 133.77 51.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 118.665 0.666 . . . . 0.0 111.005 -177.938 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.669 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 9.3 mt -93.14 166.61 12.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.394 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.469 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.7 mp -95.49 -176.8 3.88 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 165.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -59.67 -32.61 70.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.41 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 6.3 pt20 -125.28 38.58 4.15 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -176.38 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.669 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 13.3 mm-40 -75.38 -12.7 60.31 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.019 171.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.62 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 63.6 m 68.95 121.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.445 0.64 . . . . 0.0 111.943 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.56 ' H ' ' HA ' ' A' ' 30' ' ' THR . 74.9 t -75.75 -39.79 39.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.183 -173.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -72.58 -38.22 67.94 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.62 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 36.4 mt-30 -58.27 -46.77 85.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.51 172.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.18 -46.84 87.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.729 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -60.56 -26.98 67.32 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.181 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 t -75.12 -20.71 59.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -77.13 -23.12 51.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.361 0.6 . . . . 0.0 110.311 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.45 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.7 m0 -60.47 133.37 56.03 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.427 -172.208 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -113.16 11.85 18.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.695 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -156.77 167.78 33.73 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 109.081 -1.608 . . . . 0.0 109.081 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.77 105.65 17.94 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 118.02 0.91 . . . . 0.0 110.702 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.647 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -110.52 -142.84 9.4 Favored Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.586 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -158.1 160.32 37.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.104 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 1.081 ' HB3' HD11 ' A' ' 59' ' ' LEU . 95.8 m-85 -89.35 151.87 21.83 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 169.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.9 mp -132.69 128.89 58.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 O-C-N 121.933 -0.479 . . . . 0.0 110.465 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.438 HD11 HG12 ' A' ' 35' ' ' ILE . 12.8 tp -84.1 136.8 33.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -154.27 165.31 36.72 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -89.04 149.78 23.07 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 169.71 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.2 ptmm? . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.172 0.51 . . . . 0.0 109.947 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 p . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.883 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.1 p90 -130.2 149.8 51.74 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.413 ' CZ ' ' HD3' ' A' ' 24' ' ' LYS . 68.4 m-85 -89.42 138.31 31.56 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.858 -177.012 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.514 HG22 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -126.49 158.09 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.092 0.472 . . . . 0.0 109.888 176.265 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.513 ' HB2' HD11 ' A' ' 20' ' ' LEU . 5.2 pm0 -129.63 107.46 9.46 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 163.524 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -118.36 139.63 44.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.727 -174.692 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 . . . . . 0 C--N 1.315 -0.918 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.031 178.229 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.513 HD11 ' HB2' ' A' ' 10' ' ' GLN . 40.4 tp . . . . . 0 N--CA 1.447 -0.588 0 CA-C-O 121.004 0.431 . . . . 0.0 111.054 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.8 m -95.96 106.85 19.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.768 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.8 t -85.08 120.64 35.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.2 pt -130.92 168.73 23.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.891 0.377 . . . . 0.0 110.783 -177.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.413 ' HD3' ' CZ ' ' A' ' 8' ' ' PHE . 18.7 ttpp -124.87 111.93 16.05 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.031 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -117.92 164.73 18.53 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.002 -175.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.697 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 5.8 Cg_exo -68.23 143.91 60.67 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 122.203 1.936 . . . . 0.0 111.993 -179.082 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.883 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 44.7 mtp180 -64.81 -3.64 3.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.532 0.682 . . . . 0.0 110.449 -176.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.43 -7.9 11.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.697 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 0.8 OUTLIER -55.62 123.18 13.22 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 121.484 0.659 . . . . 0.0 111.875 174.508 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.615 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.2 t -100.47 178.91 4.6 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.96 170.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.532 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.34 -51.4 19.59 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.607 0.567 . . . . 0.0 111.238 -172.302 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.89 -32.05 72.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -177.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.64 -52.19 16.41 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.787 0.803 . . . . 0.0 109.368 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.418 ' CG1' HD22 ' A' ' 59' ' ' LEU . 2.3 p -66.91 -29.29 45.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.064 -178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.891 HD13 ' HG ' ' A' ' 103' ' ' LEU . 5.7 mm -56.93 -58.39 5.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.086 172.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.449 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.2 tt0 -68.51 -32.04 71.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.699 -175.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 41' ' ' LYS . 6.3 tp60 -63.8 -37.4 87.25 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 120.985 0.422 . . . . 0.0 109.976 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 27.7 m -70.53 -36.03 73.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.88 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.9 mp -55.45 -36.57 66.7 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.445 0.641 . . . . 0.0 110.375 172.072 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.9 m -70.45 -38.58 74.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.105 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 75.1 mmtt -71.02 -28.09 64.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.788 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.557 -179.375 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.655 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.172 0 CA-C-O 121.041 0.448 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.584 ' HB3' HD12 ' A' ' 35' ' ' ILE . 6.7 m-85 -106.77 137.9 43.94 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.227 -176.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.717 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.8 OUTLIER -118.83 165.71 13.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 165.827 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.511 HD11 ' HB3' ' A' ' 101' ' ' PHE . 13.9 tp -117.89 138.46 52.11 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.297 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.559 HD13 ' HA ' ' A' ' 81' ' ' VAL . 2.6 mm? -98.51 126.08 43.95 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.703 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.1 pt-20 -88.66 86.43 6.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.596 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 10.8 tt0 -86.98 121.93 30.12 Favored 'General case' 0 N--CA 1.423 -1.817 0 O-C-N 120.702 -1.249 . . . . 0.0 108.733 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.501 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.4 OUTLIER -106.03 115.84 48.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 CA-C-O 121.425 0.631 . . . . 0.0 109.366 174.742 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.72 HG23 ' HA2' ' A' ' 99' ' ' GLY . 53.4 t . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.217 -176.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.45 -0.449 0 CA-C-O 120.87 0.367 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.48 ' HB2' HG13 ' A' ' 63' ' ' VAL . 20.3 m -104.27 103.06 12.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.587 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 16.2 tt0 -95.77 130.78 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -175.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -132.06 131.38 42.37 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.559 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -88.92 137.18 21.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.446 -173.885 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.509 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 17.9 mt -97.37 159.96 14.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.707 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.628 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 7.7 mp -86.92 -169.63 2.71 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 165.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.11 -36.12 82.31 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.695 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.478 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 12.0 pt20 -125.11 44.6 2.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.628 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 8.1 mm-40 -77.33 -9.66 58.97 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 122.174 -0.329 . . . . 0.0 110.875 172.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.684 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 16.7 t 74.41 129.32 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.088 0.955 . . . . 0.0 111.415 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.615 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.6 t -78.54 -46.85 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 109.778 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -72.41 -41.4 66.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.505 -174.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.684 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 7.4 mm100 -63.26 -45.0 93.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.658 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.99 -51.26 69.95 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 110.493 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -55.49 -36.51 66.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.125 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.5 t -72.25 -15.73 61.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.454 -177.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 68.4 mmtt -90.9 -13.01 34.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.329 0.585 . . . . 0.0 110.737 -178.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 42.1 m0 -59.01 152.35 20.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.177 -174.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.489 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.3 mppt? -109.05 15.79 23.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.422 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -179.91 176.38 47.41 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 114.618 -1.174 . . . . 0.0 110.603 -176.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.485 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -94.38 106.63 18.61 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.512 0.656 . . . . 0.0 110.925 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.72 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.89 -146.76 13.48 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.073 -177.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -149.39 137.66 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.559 ' HB2' HG12 ' A' ' 11' ' ' VAL . 98.0 m-85 -84.34 146.31 27.78 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.521 -0.872 . . . . 0.0 109.324 169.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 71.3 mt -135.61 129.61 49.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 O-C-N 122.079 -0.388 . . . . 0.0 111.587 -171.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.891 ' HG ' HD13 ' A' ' 35' ' ' ILE . 9.1 mp -79.61 107.93 12.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 110.009 174.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.445 ' O ' HG23 ' A' ' 58' ' ' VAL . 32.2 ttpt -138.26 128.86 26.45 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.537 HD22 ' O ' ' A' ' 56' ' ' ASP . 19.3 mt -62.32 139.72 58.52 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.624 0.726 . . . . 0.0 112.895 -171.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.717 ' HB3' HG13 ' A' ' 58' ' ' VAL . 13.9 ptmm? . . . . . 0 C--N 1.313 -0.988 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.481 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.506 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HB3' HD11 ' A' ' 20' ' ' LEU . 41.5 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.797 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.548 ' HB2' HG13 ' A' ' 102' ' ' ILE . 78.2 m-70 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.58 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.862 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.675 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 35' ' ' ILE . 4.8 pp0? -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.535 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.832 HD13 ' HB2' ' A' ' 57' ' ' TYR . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.518 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 37.2 m-20 . . . . . 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' ' 35' ' ' ILE . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.598 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 1.044 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.735 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.648 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.543 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.862 0.363 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.611 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 36.4 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.51 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.546 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.411 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.657 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.641 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.57 ' H ' ' HA ' ' A' ' 30' ' ' THR . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 1.9 mt-30 -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.496 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.482 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.648 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 1.044 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.735 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.598 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmm? . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.588 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 11.6 m . . . . . 0 N--CA 1.445 -0.683 0 N-CA-C 109.109 -0.701 . . . . 0.0 109.109 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.664 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 9.2 p90 -135.76 149.53 49.19 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -83.77 121.48 27.36 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.303 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' HG13 ' A' ' 23' ' ' ILE . 9.2 t -99.78 128.73 51.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.056 0.455 . . . . 0.0 110.38 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.55 ' HG3' HD11 ' A' ' 20' ' ' LEU . 61.7 tt0 -100.16 106.59 18.31 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 166.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.679 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -135.47 137.16 50.13 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.242 -176.383 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 . . . . . 0 C--N 1.321 -0.656 0 N-CA-C 112.127 0.418 . . . . 0.0 112.127 -173.344 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.55 HD11 ' HG3' ' A' ' 10' ' ' GLN . 46.1 tp . . . . . 0 N--CA 1.449 -0.489 0 CA-C-O 120.68 0.276 . . . . 0.0 110.626 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.3 m -104.06 110.26 22.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.193 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.8 p -99.75 128.29 51.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.301 0.572 . . . . 0.0 109.637 173.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.555 HG13 ' HB ' ' A' ' 9' ' ' VAL . 9.1 pt -137.66 159.97 34.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.696 -178.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.588 ' HE3' ' HB2' ' A' ' 6' ' ' SER . 18.8 tttp -114.48 97.8 6.52 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.457 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -110.31 169.31 6.5 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.055 -170.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.88 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.5 Cg_endo -71.9 140.1 34.44 Favored 'Trans proline' 0 N--CA 1.443 -1.442 0 C-N-CA 121.48 1.453 . . . . 0.0 110.612 -176.252 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.664 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 98.9 mtt180 -57.72 -36.48 72.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.8 -13.94 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 113.944 -1.48 . . . . 0.0 112.617 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.88 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 80.1 p -58.45 124.76 20.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.679 0.752 . . . . 0.0 110.757 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.552 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.2 t -100.66 179.63 4.36 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.927 171.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.67 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.51 -50.39 23.55 Favored 'General case' 0 C--O 1.209 -1.068 0 O-C-N 123.422 0.451 . . . . 0.0 110.745 -174.779 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.418 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 2.6 mm-40 -59.69 -31.91 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -72.8 -53.35 11.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 122.168 0.985 . . . . 0.0 109.641 -176.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.682 HG11 HD22 ' A' ' 59' ' ' LEU . 2.6 p -65.42 -27.7 42.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.074 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.791 HD13 HD12 ' A' ' 103' ' ' LEU . 10.1 mm -56.74 -56.07 16.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.363 168.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.852 ' HA ' HD12 ' A' ' 39' ' ' LEU . 6.6 tp-100 -59.98 -45.49 92.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.941 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -59.1 -39.17 81.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.649 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.505 ' HB ' HD13 ' A' ' 103' ' ' LEU . 29.5 m -69.02 -41.13 78.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.73 0.3 . . . . 0.0 110.293 176.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 36' ' ' GLN . 29.7 mt -56.8 -38.84 73.11 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 120.986 0.422 . . . . 0.0 110.308 175.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.03 -52.98 44.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.783 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -80.34 -9.26 59.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 O-C-N 122.396 -0.19 . . . . 0.0 111.097 179.789 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.539 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.7 m-20 . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 110.522 -0.177 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.632 ' HB3' HD12 ' A' ' 35' ' ' ILE . 49.5 m-85 -123.24 143.92 49.73 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.397 0.618 . . . . 0.0 111.799 -175.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.649 HG13 ' HB3' ' A' ' 106' ' ' LYS . 3.1 m -127.66 165.99 25.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.411 166.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.682 HD22 HG11 ' A' ' 34' ' ' VAL . 12.2 tp -112.59 152.02 29.38 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.911 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.6 OUTLIER -109.3 140.19 43.28 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.042 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.686 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.1 pt-20 -105.58 87.14 2.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.117 0.961 . . . . 0.0 109.096 170.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.645 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.1 tt0 -86.58 123.72 32.09 Favored 'General case' 0 N--CA 1.42 -1.939 0 O-C-N 121.19 -0.944 . . . . 0.0 109.376 173.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.552 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -111.82 117.59 55.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.994 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.578 HG23 ' HA2' ' A' ' 99' ' ' GLY . 92.7 t . . . . . 0 CA--C 1.514 -0.406 0 CA-C-O 121.601 0.715 . . . . 0.0 109.313 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.451 -0.41 0 CA-C-O 121.418 0.627 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.7 m -102.96 100.0 9.93 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.605 171.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.645 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.0 tt0 -94.33 132.69 38.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.942 -174.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.607 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 6.2 tpp180 -127.73 160.71 30.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.673 HG13 HD13 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -115.71 144.71 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 118.381 0.537 . . . . 0.0 110.474 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.666 HD21 ' HB3' ' A' ' 61' ' ' GLU . 20.8 mt -104.84 152.07 23.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.672 -174.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.415 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 7.3 mp -81.36 169.67 16.94 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 166.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -41.39 62.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.9 0.381 . . . . 0.0 111.389 -176.467 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.437 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 14.1 pt20 -114.09 32.03 6.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.59 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 22.6 tp10 -63.39 -20.69 65.75 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.992 0.425 . . . . 0.0 110.331 175.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.619 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 73.9 m 72.09 122.27 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.208 178.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.552 ' H ' ' HA ' ' A' ' 30' ' ' THR . 90.9 t -75.27 -38.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.25 -171.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -72.92 -33.96 66.29 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.619 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.8 OUTLIER -65.43 -40.57 93.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.192 176.781 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.515 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -68.88 -40.32 79.32 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.687 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.63 -36.03 79.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.135 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -70.51 -15.36 62.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.545 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 88.6 mttt -75.55 -24.98 56.75 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.011 0.434 . . . . 0.0 110.434 177.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.443 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.1 m0 -63.68 153.95 34.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -167.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mtmm -135.81 24.99 3.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.176 -1.375 . . . . 0.0 108.205 175.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.479 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -169.28 153.5 22.12 Favored Glycine 0 N--CA 1.44 -1.055 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.37 10.59 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.283 1.041 . . . . 0.0 111.062 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.578 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.38 -154.35 20.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.894 -176.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HB2' ' HE3' ' A' ' 100' ' ' LYS . 1.3 mtmt -146.32 143.88 29.43 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.679 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -80.42 153.06 28.5 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 169.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.911 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 92.9 mt -135.57 128.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 O-C-N 122.02 -0.425 . . . . 0.0 111.426 -173.336 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.791 HD12 HD13 ' A' ' 35' ' ' ILE . 3.4 tp -77.7 130.46 36.82 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.115 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 1.1 tppt? -151.61 175.79 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.568 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.7 mp -101.92 133.33 46.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.86 0.362 . . . . 0.0 110.416 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.649 ' HB3' HG13 ' A' ' 58' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.873 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.074 173.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.7 p . . . . . 0 N--CA 1.446 -0.655 0 CA-C-O 121.219 0.533 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.869 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -124.14 156.7 36.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.214 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.46 ' CZ ' ' HE2' ' A' ' 24' ' ' LYS . 43.7 m-85 -84.75 125.22 32.36 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.22 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.6 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.9 t -113.76 129.32 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.457 178.269 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.626 ' HB3' HD11 ' A' ' 20' ' ' LEU . 44.9 mt-30 -97.96 108.54 21.28 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 164.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.787 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -120.08 115.19 46.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-O 121.51 0.672 . . . . 0.0 110.406 177.831 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.595 ' HB2' HG13 ' A' ' 102' ' ' ILE . 19.1 m80 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.266 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.626 HD11 ' HB3' ' A' ' 10' ' ' GLN . 27.0 tp . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.57 0.224 . . . . 0.0 110.489 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.6 m -92.06 109.45 20.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 173.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 50.0 t -95.81 110.69 24.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.6 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.2 pt -116.68 168.28 8.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.891 0.377 . . . . 0.0 110.706 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HE2' ' CZ ' ' A' ' 8' ' ' PHE . 19.0 tttm -117.1 96.05 5.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 169.25 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -100.47 167.49 10.82 Favored Pre-proline 0 CA--C 1.506 -0.712 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.461 -175.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.887 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 5.6 Cg_exo -68.74 141.98 51.27 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 121.535 1.49 . . . . 0.0 111.523 -177.507 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.869 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 35.5 mtp180 -66.33 -0.45 2.64 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.601 0.715 . . . . 0.0 109.966 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.415 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.5 m -114.12 -2.44 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.461 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.887 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.2 p -59.86 119.69 8.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.277 0.561 . . . . 0.0 109.859 175.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.496 ' C ' HG23 ' A' ' 88' ' ' VAL . 17.8 p -94.15 -173.82 3.21 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -55.8 -49.92 71.89 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.711 -176.162 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -30.71 71.08 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -178.817 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -70.68 -53.74 14.54 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.485 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 31' ' ' ALA . 2.2 p -66.59 -27.6 40.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 113.599 -1.637 . . . . 0.0 110.135 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 31' ' ' ALA . 4.3 mm -55.88 -58.15 5.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.584 174.006 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.558 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 54.7 mt-30 -73.28 -32.77 64.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.752 0.31 . . . . 0.0 110.894 -175.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -60.99 -37.3 81.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-O 120.775 0.322 . . . . 0.0 110.216 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.609 ' HA ' ' HB3' ' A' ' 41' ' ' LYS . 32.6 m -75.68 -30.18 59.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.272 175.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 5.9 mp -55.68 -47.93 75.91 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-O 120.961 0.41 . . . . 0.0 109.943 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.8 m -67.16 -37.21 83.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.542 0.687 . . . . 0.0 110.161 176.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.609 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 27.9 tptp -69.86 -10.28 57.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.069 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.262 -179.742 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 CA--C 1.512 -0.51 0 CA-C-O 120.545 0.212 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.539 ' HB3' HD12 ' A' ' 35' ' ' ILE . 20.8 m-85 -118.54 134.45 55.08 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.259 0.552 . . . . 0.0 112.149 -171.684 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.87 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -108.69 178.8 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.445 163.158 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 1.108 HD11 ' HB3' ' A' ' 101' ' ' PHE . 3.0 tm? -131.04 132.84 45.21 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -98.83 125.97 44.35 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.546 -175.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.0 pt-20 -88.74 86.0 6.89 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.36 1.076 . . . . 0.0 108.508 170.077 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.607 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 17.9 tt0 -85.53 122.66 29.98 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.525 -0.735 . . . . 0.0 109.145 175.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.566 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.3 OUTLIER -115.61 117.92 57.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 121.449 0.642 . . . . 0.0 110.08 176.194 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.554 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 59.3 t . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.016 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 6.8 p . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 121.153 0.502 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.1 m -82.16 104.93 12.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.489 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.572 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 18.5 tt0 -94.34 131.21 40.21 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -176.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.521 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 29.4 ttt180 -126.68 149.85 49.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.548 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -105.8 139.5 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.822 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.685 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 23.6 mt -96.86 156.89 16.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.306 0.574 . . . . 0.0 111.578 -176.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.525 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 47.2 mt -76.98 168.45 20.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 162.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.16 -40.13 64.08 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -120.73 35.69 4.8 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.695 0.283 . . . . 0.0 111.669 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.685 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 23.9 tp10 -65.57 -17.68 64.76 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.022 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.572 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 18.9 m 78.2 109.48 0.07 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.521 176.045 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.496 HG23 ' C ' ' A' ' 30' ' ' THR . 86.8 t -55.71 -45.84 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.332 173.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -73.72 -35.54 65.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.66 -175.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.572 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 57.5 mt-30 -62.31 -45.37 93.56 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 173.19 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.24 90.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.677 177.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -54.41 -47.35 72.86 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.81 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.7 t -75.29 -4.44 39.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 0.0 110.466 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -99.35 -6.69 27.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.963 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.508 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -72.59 161.12 31.19 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.724 0.773 . . . . 0.0 112.541 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -128.77 21.59 5.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.02 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -178.0 169.59 41.5 Favored Glycine 0 N--CA 1.44 -1.078 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.248 -178.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.466 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -88.58 102.96 15.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 117.347 0.574 . . . . 0.0 111.376 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.607 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -111.09 -149.18 11.57 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.422 -0.894 . . . . 0.0 111.898 177.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.4 mptp? -152.61 155.01 36.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 1.108 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.4 m-85 -86.91 116.73 25.17 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 173.17 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.595 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -101.46 122.91 54.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 O-C-N 122.013 -0.429 . . . . 0.0 110.365 -173.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.506 ' CD1' HD13 ' A' ' 35' ' ' ILE . 7.5 tp -74.2 135.52 42.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -160.81 149.39 16.41 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.624 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.533 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 10.9 mp -70.39 141.68 52.15 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.204 174.092 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.87 ' HB3' HG13 ' A' ' 58' ' ' VAL . 14.3 ptpt . . . . . 0 C--N 1.317 -0.825 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.907 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p . . . . . 0 N--CA 1.444 -0.737 0 CA-C-O 120.904 0.383 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.531 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 6.0 p90 -147.87 155.46 41.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.5 ' CZ ' ' HD2' ' A' ' 24' ' ' LYS . 65.7 m-85 -87.08 129.61 34.84 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.188 -175.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.583 ' HB ' HG13 ' A' ' 23' ' ' ILE . 22.1 t -109.09 131.34 60.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.087 0.47 . . . . 0.0 110.767 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HG2' ' HG2' ' A' ' 100' ' ' LYS . 34.6 tt0 -101.57 106.49 17.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 166.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.626 ' HB ' ' HB2' ' A' ' 101' ' ' PHE . 1.8 p -139.57 137.89 39.82 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-O 120.883 0.373 . . . . 0.0 111.337 -172.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.596 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 94.0 m-70 . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.975 0.417 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 87.8 m -98.24 121.15 39.82 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.05 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.1 t -110.82 111.33 35.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 0.0 109.846 176.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.583 HG13 ' HB ' ' A' ' 9' ' ' VAL . 2.5 pt -124.12 159.83 29.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.298 -178.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HD2' ' CZ ' ' A' ' 8' ' ' PHE . 1.4 ttpm? -109.95 96.55 6.31 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 171.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.69 163.67 18.03 Favored Pre-proline 0 CA--C 1.504 -0.82 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.929 -175.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.984 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.3 Cg_exo -68.42 145.91 66.69 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.704 1.603 . . . . 0.0 110.974 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.531 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 73.6 mtt180 -62.02 -15.69 46.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.781 0.801 . . . . 0.0 109.634 -178.165 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.3 m -98.13 -4.59 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.3 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.984 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.7 p -55.72 123.25 13.52 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.786 0.803 . . . . 0.0 110.476 178.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.546 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 1.0 OUTLIER -103.53 174.61 5.79 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.991 173.246 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.15 -51.19 18.85 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 123.522 0.514 . . . . 0.0 111.331 -173.227 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.404 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 15.2 tp60 -60.92 -31.6 71.12 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.463 -178.5 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -78.76 -51.86 9.19 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 -177.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.447 HG11 HG21 ' A' ' 88' ' ' VAL . 2.9 p -60.55 -28.54 42.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.765 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.655 HD13 ' HG ' ' A' ' 103' ' ' LEU . 5.8 mm -56.45 -57.86 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.052 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.524 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 28.4 tt0 -70.76 -32.37 69.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.201 -174.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.402 HE22 ' HD3' ' A' ' 26' ' ' PRO . 28.1 tt0 -60.87 -38.01 84.11 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.978 0.418 . . . . 0.0 110.251 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.5 m -71.01 -31.92 68.56 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.078 175.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -62.42 -33.7 75.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.409 0.623 . . . . 0.0 110.806 173.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t -78.24 -36.74 46.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.812 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -70.98 -50.33 35.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.216 0.531 . . . . 0.0 110.179 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.023 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 8.1 m-20 . . . . . 0 CA--C 1.515 -0.388 0 CA-C-O 121.025 0.441 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.596 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 47.0 m-85 -107.62 156.52 18.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.093 -177.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.669 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.38 169.21 21.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 167.419 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 1.07 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -123.0 139.62 53.89 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -174.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.641 HD13 HG13 ' A' ' 81' ' ' VAL . 1.0 OUTLIER -103.11 128.63 49.96 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.017 -177.207 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.7 ' HG3' ' HB3' ' A' ' 80' ' ' ARG . 9.4 pt-20 -92.94 87.3 5.73 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.037 0.922 . . . . 0.0 108.96 171.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 9.7 tt0 -85.7 123.3 30.93 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.026 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.573 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.37 116.66 52.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.589 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t . . . . . 0 C--N 1.317 -0.814 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.309 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 19.8 m . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 m -92.97 103.9 16.18 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.2 tt0 -94.85 131.29 40.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.892 0.377 . . . . 0.0 110.217 -174.536 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.7 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 38.8 ttm180 -127.2 158.12 37.96 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.641 HG13 HD13 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -112.62 144.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 118.355 0.525 . . . . 0.0 110.819 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 19.8 mt -100.01 -177.07 3.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.31 0.576 . . . . 0.0 111.524 -176.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.794 ' H ' ' HB3' ' A' ' 86' ' ' GLU . 17.1 mt -117.62 -170.83 1.94 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.962 -179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.44 -30.66 71.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.164 0.507 . . . . 0.0 109.874 175.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.69 19.78 5.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -177.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.794 ' HB3' ' H ' ' A' ' 83' ' ' LEU . 13.7 tp10 -79.27 80.82 5.6 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 123.085 1.421 . . . . 0.0 107.771 169.249 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 58.1 m -35.63 135.45 0.28 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-N 110.257 -3.156 . . . . 0.0 113.68 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.535 ' H ' ' HA ' ' A' ' 30' ' ' THR . 55.3 t -76.16 -41.47 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.468 -175.543 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -72.44 -33.99 67.46 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.657 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 1.6 mt-30 -64.37 -42.19 96.3 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.299 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.549 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -63.19 -45.75 90.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.681 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -59.63 -29.72 68.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.693 -178.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.1 p -76.95 -20.69 55.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.343 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.549 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 75.1 mttt -73.02 -30.0 63.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.37 0.605 . . . . 0.0 110.209 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.485 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -49.09 128.84 17.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.872 -167.381 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.542 ' H ' HG21 ' A' ' 63' ' ' VAL . 22.4 mtpp -97.21 20.11 11.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.043 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 179.16 -171.56 43.55 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.595 -177.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -103.14 111.25 23.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.772 0.786 . . . . 0.0 110.768 178.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.573 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -116.45 -149.28 9.2 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.12 -177.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.688 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 2.0 mtmt -151.11 145.53 25.53 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 1.07 ' HB3' HD11 ' A' ' 59' ' ' LEU . 98.0 m-85 -79.2 154.22 29.41 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 67.3 mt -142.93 129.62 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 O-C-N 121.679 -0.638 . . . . 0.0 111.65 -174.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.655 ' HG ' HD13 ' A' ' 35' ' ' ILE . 5.8 mp -73.36 141.54 47.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.902 0.382 . . . . 0.0 110.98 176.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.487 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 9.3 tppt? -154.06 176.29 12.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.409 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.596 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.0 mp -101.28 142.57 32.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.164 0.507 . . . . 0.0 110.05 174.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.669 ' HB3' HG13 ' A' ' 58' ' ' VAL . 16.9 ptmt . . . . . 0 C--N 1.311 -1.07 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.008 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.03 0.443 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 p 179.37 -160.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.53 -33.34 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -72.7 125.76 28.27 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.838 173.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.486 ' OE2' ' HD2' ' A' ' 27' ' ' ARG . 29.3 tt0 -104.82 141.12 37.07 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.21 -170.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.506 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m -91.01 133.33 35.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 168.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HB3' HD11 ' A' ' 20' ' ' LEU . 41.5 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.797 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.548 ' HB2' HG13 ' A' ' 102' ' ' ILE . 78.2 m-70 -77.26 143.52 38.85 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -135.48 170.22 16.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.492 ' CG2' HD11 ' A' ' 48' ' ' ILE . 10.4 m -86.24 -1.08 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-O 120.632 0.253 . . . . 0.0 111.584 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -62.48 128.89 92.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.984 0.421 . . . . 0.0 110.295 172.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.7 170.48 19.92 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.024 2.483 . . . . 0.0 113.011 -176.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 18' ' ' GLN . 11.8 tp10 61.43 94.2 0.04 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.927 -175.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 13.2 mm-40 66.33 76.52 0.29 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.146 -170.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.21 -32.1 93.96 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.677 2.251 . . . . 0.0 111.195 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp -80.8 106.45 12.81 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.618 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.58 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.862 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.675 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 35' ' ' ILE . 4.8 pp0? -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.535 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.832 HD13 ' HB2' ' A' ' 57' ' ' TYR . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -116.07 16.77 16.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.867 ' HA ' HD21 ' A' ' 49' ' ' LEU . 36.2 ttmt -62.45 110.15 1.58 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.237 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.512 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 32.8 m-85 70.7 -12.32 0.56 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.579 1.152 . . . . 0.0 112.142 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.4 m -54.72 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -99.05 6.78 46.45 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.42 ' C ' ' H ' ' A' ' 49' ' ' LEU . 30.3 t 57.45 42.72 24.16 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.275 -176.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.492 HD11 ' CG2' ' A' ' 14' ' ' VAL . 22.5 mm -63.52 -9.6 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.832 171.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.867 HD21 ' HA ' ' A' ' 43' ' ' LYS . 1.3 mm? -73.24 9.51 1.25 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.102 -1.408 . . . . 0.0 111.557 -171.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -59.94 -32.41 70.77 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -120.55 86.01 39.0 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.78 7.05 3.34 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.275 1.983 . . . . 0.0 113.012 -172.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -113.77 136.84 22.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.929 178.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.455 ' HB3' ' HB2' ' A' ' 36' ' ' GLN . 65.6 Cg_endo -75.61 7.51 3.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.122 2.548 . . . . 0.0 112.869 -175.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.453 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 4.2 m -88.23 -13.2 41.62 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.864 -174.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.518 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 37.2 m-20 -109.94 15.02 22.87 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 -176.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' ' 35' ' ' ILE . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.598 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 1.044 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.735 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.648 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.543 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t -67.72 112.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.437 ' HG2' HG22 ' A' ' 63' ' ' VAL . 24.7 mmmt -123.12 95.13 4.49 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.788 -1.096 . . . . 0.0 108.973 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 6.8 p-10 -60.77 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.402 -175.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.8 t -122.93 114.32 20.28 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.389 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 m -69.61 -36.62 76.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.212 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -87.02 -152.37 0.19 Allowed 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 70' ' ' LYS . 48.3 mtpt -113.81 81.51 1.54 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.199 0.523 . . . . 0.0 110.975 173.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -104.76 -31.57 9.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.602 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.494 HG22 ' H ' ' A' ' 74' ' ' THR . 14.5 m -139.33 143.87 38.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.386 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -64.61 -19.73 65.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.0 111.215 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.494 ' H ' HG22 ' A' ' 72' ' ' THR . 7.3 p -137.8 160.42 64.84 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.859 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.7 133.61 45.03 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.277 1.985 . . . . 0.0 111.598 172.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.582 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 21.3 pttp -112.87 164.92 12.82 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.61 -168.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m -113.63 139.98 48.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.008 -177.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.611 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 36.4 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.51 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.664 HG11 HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.411 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.657 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.641 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.57 ' H ' ' HA ' ' A' ' 30' ' ' THR . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 1.9 mt-30 -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.496 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.482 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.648 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 1.044 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.735 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.598 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmm? -84.95 -19.69 31.77 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.67 -13.43 60.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.562 168.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -103.15 -8.87 20.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.307 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.664 HG21 HG11 ' A' ' 81' ' ' VAL . 0.5 OUTLIER -101.21 7.72 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.08 176.434 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -50.73 89.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 113.529 -168.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.27 18.04 0.48 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.285 -1.325 . . . . 0.0 107.991 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.5 t -104.81 60.61 0.69 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.861 -172.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.421 ' HB2' ' H ' ' A' ' 114' ' ' GLU . 13.6 mmt180 60.31 -92.53 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.328 175.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.421 ' H ' ' HB2' ' A' ' 113' ' ' ARG . 8.6 tp10 -147.97 143.52 27.36 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -113.86 -39.83 3.9 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.932 0.396 . . . . 0.0 110.754 -176.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.5 pttp . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.198 -177.274 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 t -75.08 121.73 22.49 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.446 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 1.3 pm0 -81.8 78.65 8.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.708 0.766 . . . . 0.0 111.397 -178.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.85 160.98 20.03 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.92 171.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -102.48 108.29 19.55 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.526 0.679 . . . . 0.0 111.378 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 p -139.95 137.77 35.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.76 175.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.772 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 12.5 p90 -113.8 154.77 26.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.061 -175.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -87.2 129.81 34.81 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 111.333 -176.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.584 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.5 t -115.73 127.82 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.348 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.584 ' HB3' HD11 ' A' ' 20' ' ' LEU . 34.6 mt-30 -102.05 107.09 18.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.783 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.6 OUTLIER -130.22 130.67 65.77 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.709 -174.812 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -74.63 138.67 43.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.466 -175.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -93.81 178.83 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.602 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.6 t -91.25 -23.95 5.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.885 0.374 . . . . 0.0 110.575 -178.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.465 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.7 t -97.95 142.79 25.13 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.894 0.378 . . . . 0.0 110.586 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 15' ' ' SER . 23.6 Cg_exo -64.81 -22.76 63.28 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.957 3.104 . . . . 0.0 114.755 -170.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -67.08 -19.55 65.67 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.057 -0.402 . . . . 0.0 111.523 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -124.01 78.41 58.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-O 120.907 0.384 . . . . 0.0 110.02 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.6 -37.66 28.15 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.542 2.161 . . . . 0.0 110.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.584 HD11 ' HB3' ' A' ' 10' ' ' GLN . 56.4 tp -134.71 103.21 5.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.172 174.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.625 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 29.7 m -82.09 109.44 16.41 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.341 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.12 111.22 24.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.923 0.392 . . . . 0.0 109.979 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.584 HG13 ' HB ' ' A' ' 9' ' ' VAL . 17.7 pt -122.36 173.25 8.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.778 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -122.03 97.61 5.56 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.22 160.28 30.16 Favored Pre-proline 0 CA--C 1.504 -0.795 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.755 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.856 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.8 Cg_exo -66.01 141.83 65.81 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 121.848 1.699 . . . . 0.0 111.386 -177.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.772 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 38.0 mtp180 -63.69 -0.57 1.03 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.609 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.435 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.6 m -114.35 -9.96 12.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.642 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.856 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.6 p -53.86 133.45 42.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 110.935 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 21.4 p -96.81 -169.99 1.97 Allowed 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.572 ' HA ' HG13 ' A' ' 88' ' ' VAL . . . -59.03 -48.55 81.19 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.248 178.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.45 -32.59 67.09 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 123.15 0.281 . . . . 0.0 111.398 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -74.44 -53.74 8.96 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 122.245 1.022 . . . . 0.0 109.94 -176.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 88' ' ' VAL . 5.1 p -65.95 -27.47 41.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.126 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.823 HD13 HD12 ' A' ' 103' ' ' LEU . 3.1 mm -56.07 -58.22 5.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.141 171.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 28.2 tt0 -72.45 -32.33 66.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.293 -175.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -59.47 -35.26 73.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 122.106 -0.371 . . . . 0.0 110.683 176.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.9 m -68.89 -41.09 78.75 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 9.7 mp -54.13 -40.88 67.8 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.653 172.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.8 t -67.81 -33.31 74.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.468 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -73.18 -32.73 65.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.397 0.618 . . . . 0.0 109.972 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.473 ' HB1' ' HB ' ' A' ' 48' ' ' ILE . . . -97.91 26.15 5.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.423 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HA ' HD21 ' A' ' 49' ' ' LEU . 14.0 tptp -80.6 99.46 8.13 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.324 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.422 ' HD2' ' HG3' ' A' ' 43' ' ' LYS . 79.7 m-85 68.52 3.62 3.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.487 0.715 . . . . 0.0 112.915 177.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.9 m -64.26 -70.43 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.055 0.455 . . . . 0.0 110.51 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -111.97 14.82 20.87 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.372 -0.974 . . . . 0.0 108.372 172.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.2 t 59.37 92.13 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 113.702 -1.59 . . . . 0.0 111.351 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.473 ' HB ' ' HB1' ' A' ' 42' ' ' ALA . 2.0 tt -102.22 0.06 10.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 122.027 0.918 . . . . 0.0 108.975 175.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.455 HD21 ' HA ' ' A' ' 43' ' ' LYS . 48.6 mt -84.05 34.63 0.51 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.591 -162.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 p -68.35 -33.28 73.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 168.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -122.17 86.43 47.27 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.211 168.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.58 4.08 5.86 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.546 2.164 . . . . 0.0 111.677 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.496 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.7 p-10 -110.97 135.15 20.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.961 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.63 ' HB3' HG22 ' A' ' 35' ' ' ILE . 2.5 Cg_endo -81.68 6.58 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.746 2.297 . . . . 0.0 112.013 -179.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.516 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 6.1 m -71.3 -29.91 65.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.808 -173.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -97.5 8.87 43.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.985 0.421 . . . . 0.0 110.985 -176.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 29.9 m-85 -109.89 150.15 28.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.183 0.516 . . . . 0.0 111.098 -177.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -126.06 160.33 33.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.675 168.792 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 1.028 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.2 tm? -116.78 135.03 54.07 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.866 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.8 OUTLIER -98.41 130.71 45.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.09 -176.94 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.663 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.8 pt-20 -96.93 91.11 5.46 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.435 1.112 . . . . 0.0 108.52 169.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.658 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 3.3 tt0 -88.21 123.03 32.43 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 121.227 -0.921 . . . . 0.0 109.705 172.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.507 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -112.45 117.46 55.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.316 0.579 . . . . 0.0 109.564 169.836 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.67 HG23 ' HA2' ' A' ' 99' ' ' GLY . 51.8 t -86.5 118.76 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.21 -176.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' ' 65' ' ' LYS . 13.3 ptpt -110.71 90.5 3.34 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 168.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 3.7 p-10 -71.02 -97.86 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.3 -169.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.422 ' H ' ' CG ' ' A' ' 66' ' ' ASP . 1.9 t -157.92 88.78 0.98 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.604 0.716 . . . . 0.0 110.312 176.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 p -82.33 26.74 0.53 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.791 -177.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.405 ' HB2' ' H ' ' A' ' 70' ' ' LYS . 1.2 m-80 -120.79 -85.26 0.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.67 0.747 . . . . 0.0 109.222 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.826 ' HA ' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -128.73 -142.7 0.26 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.691 177.244 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.43 ' H ' ' HB3' ' A' ' 70' ' ' LYS . 3.1 tppp? -94.55 64.53 3.06 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 171.072 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.3 m -79.66 100.94 8.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.989 -175.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.2 p 51.4 -117.95 1.19 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.468 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.0 p -127.35 151.1 74.25 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.06 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.582 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 80.8 Cg_exo -53.07 136.91 62.27 Favored 'Trans proline' 0 CA--C 1.514 -0.51 0 C-N-CA 122.797 2.332 . . . . 0.0 111.734 171.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -106.27 98.28 7.98 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.377 -171.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.7 p -79.82 103.91 10.04 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.509 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.422 ' HB2' HG13 ' A' ' 63' ' ' VAL . 17.9 m -83.86 96.94 8.94 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 176.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.0 tt0 -97.79 131.7 44.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.879 -0.601 . . . . 0.0 109.993 -175.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.573 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 24.5 ttt180 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.69 HG13 HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -110.35 140.55 28.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.482 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.5 mt -100.89 150.11 23.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.215 0.531 . . . . 0.0 111.653 -174.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.36 156.36 38.45 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 162.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.16 -32.99 38.37 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.811 0.338 . . . . 0.0 111.738 -175.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -110.38 19.64 18.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.8 -9.56 45.38 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.835 178.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 85.4 m 68.44 106.73 0.05 Allowed 'General case' 0 C--O 1.219 -0.537 0 O-C-N 123.931 0.769 . . . . 0.0 111.471 175.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 34' ' ' VAL . 17.0 m -72.34 -32.08 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.159 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -73.47 -37.19 65.86 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 118.881 -1.128 . . . . 0.0 109.042 178.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.637 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 57.4 mt-30 -62.0 -45.74 92.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.84 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.8 -44.03 81.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.74 -37.58 76.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.049 -178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 65.1 p -76.28 -11.99 60.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.835 0.35 . . . . 0.0 111.318 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 86.5 mttt -82.91 -21.8 34.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.228 0.537 . . . . 0.0 109.705 177.082 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.443 ' CG ' ' HB ' ' A' ' 63' ' ' VAL . 43.4 m0 -64.34 157.77 25.33 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.719 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.422 ' H ' HG21 ' A' ' 63' ' ' VAL . 62.2 mttm -137.7 19.23 2.87 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.174 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -160.6 165.61 35.11 Favored Glycine 0 N--CA 1.441 -0.978 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -86.76 104.76 16.45 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 117.99 0.895 . . . . 0.0 110.816 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.67 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -107.76 -147.61 13.47 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.147 -1.025 . . . . 0.0 112.147 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -150.43 153.93 36.81 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 176.136 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 1.028 ' HB3' HD11 ' A' ' 59' ' ' LEU . 96.8 m-85 -87.0 154.74 20.54 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 166.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.866 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 4.9 mp -135.18 127.18 47.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 121.66 -0.65 . . . . 0.0 110.951 -178.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.823 HD12 HD13 ' A' ' 35' ' ' ILE . 7.6 tp -83.14 127.53 33.68 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.606 ' HG2' ' CG2' ' A' ' 109' ' ' VAL . 5.6 tppt? -149.11 175.82 11.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.573 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.1 mp -98.17 144.17 27.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 0.0 110.491 172.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.725 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmt -85.31 -21.82 28.79 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.166 -176.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -83.83 4.73 27.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.424 0.63 . . . . 0.0 110.392 174.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -121.78 -38.15 2.78 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.606 ' CG2' ' HG2' ' A' ' 104' ' ' LYS . 57.3 t -88.7 75.21 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 164.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -90.81 9.52 29.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.153 -174.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.14 8.72 12.27 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.896 171.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 15.2 m -92.81 -0.19 57.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.346 -178.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -101.26 88.59 3.52 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.317 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -77.73 81.9 4.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.618 0.723 . . . . 0.0 109.146 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -89.06 178.46 6.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.507 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.995 -176.384 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.7 m . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 120.696 0.284 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t -145.04 157.98 43.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.241 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -80.25 -5.94 57.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.594 0.235 . . . . 0.0 111.059 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -84.6 3.04 38.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.396 0.617 . . . . 0.0 110.256 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -136.44 115.18 12.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.209 176.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.406 ' OG ' ' HE2' ' A' ' 24' ' ' LYS . 57.1 p -157.3 155.16 30.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.322 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.626 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 6.9 p90 -148.66 153.5 38.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -90.9 128.25 36.69 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.505 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.575 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.6 t -108.97 125.66 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.254 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.606 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 84.1 mt-30 -93.61 107.38 19.24 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.794 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -124.14 115.69 45.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.429 0.633 . . . . 0.0 110.576 -178.353 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.584 ' HB2' HG13 ' A' ' 102' ' ' ILE . 45.0 m-70 -69.68 145.48 52.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.601 -175.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.89 167.03 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.53 -21.57 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.387 0.613 . . . . 0.0 109.613 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.2 m -75.67 160.7 78.54 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.222 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.499 ' O ' ' HB3' ' A' ' 17' ' ' GLU . 61.1 Cg_endo -73.81 -144.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.627 2.218 . . . . 0.0 111.822 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 16' ' ' PRO . 8.0 tp10 71.66 -64.26 0.39 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.6 tp60 -155.06 96.85 2.48 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -52.84 -35.53 70.4 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.037 2.491 . . . . 0.0 112.446 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.561 HD11 ' HB3' ' A' ' 10' ' ' GLN . 52.7 tp -105.04 96.42 6.52 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.526 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 34.1 m -71.43 108.95 5.1 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.202 -176.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.4 t -96.14 111.06 25.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.4 pt -118.8 176.51 3.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.701 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.406 ' HE2' ' OG ' ' A' ' 6' ' ' SER . 51.4 tttt -124.9 97.75 5.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -98.86 170.98 6.22 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.138 -176.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.873 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.8 Cg_endo -75.64 140.8 24.14 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 C-N-CA 122.165 1.91 . . . . 0.0 110.14 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.626 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 90.7 mtt180 -54.24 -42.92 70.43 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 m -68.63 -10.37 13.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.951 178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.873 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 85.9 p -57.02 128.77 38.66 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.422 0.63 . . . . 0.0 110.783 177.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.514 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -102.3 179.19 4.38 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 171.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.787 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.42 -50.3 31.61 Favored 'General case' 0 C--O 1.213 -0.865 0 O-C-N 123.297 0.373 . . . . 0.0 111.013 -174.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.499 ' OE1' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -56.35 -35.45 67.65 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.96 -52.97 11.15 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.935 0.874 . . . . 0.0 110.021 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 59' ' ' LEU . 5.3 p -63.13 -27.44 43.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.89 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.787 HG12 ' O ' ' A' ' 31' ' ' ALA . 3.5 mm -55.75 -58.26 5.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.128 173.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.488 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 52.6 tp60 -69.39 -33.63 73.31 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.024 -177.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.435 HE22 ' HA ' ' A' ' 25' ' ' ALA . 17.6 tt0 -65.52 -36.67 84.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.48 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.2 m -70.52 -35.62 73.27 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.552 HD13 ' O ' ' A' ' 35' ' ' ILE . 6.9 mp -54.44 -46.21 73.22 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.443 171.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.06 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -79.95 -23.3 41.79 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.777 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.5 ' HA ' ' CD1' ' A' ' 46' ' ' TYR . . . -101.66 -18.84 15.67 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -172.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.582 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -56.8 115.58 2.66 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.03 -179.104 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.796 ' HA ' HD21 ' A' ' 49' ' ' LEU . 84.1 m-85 68.42 -43.45 0.49 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.496 1.118 . . . . 0.0 111.461 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.4 ' H ' ' C ' ' A' ' 43' ' ' LYS . 35.1 m -49.9 -61.14 2.31 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.108 0.963 . . . . 0.0 111.927 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 42' ' ' ALA . 2.7 m-85 -95.69 15.43 20.07 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 46.59 37.4 4.46 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 114.259 -1.337 . . . . 0.0 111.489 -170.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.494 ' HB ' ' HB1' ' A' ' 42' ' ' ALA . 30.6 mm -86.23 85.55 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.103 173.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.796 HD21 ' HA ' ' A' ' 44' ' ' TYR . 2.7 mm? -124.92 -7.56 7.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.483 -178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -66.53 -43.41 85.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.407 . . . . 0.0 110.531 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.03 90.25 48.7 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.564 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -86.19 -1.49 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.047 2.498 . . . . 0.0 111.793 176.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -95.45 127.71 40.96 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.482 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.499 ' HB2' ' OE1' ' A' ' 32' ' ' GLN . 83.9 Cg_endo -80.45 2.02 8.82 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.9 2.4 . . . . 0.0 112.6 -175.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 p -77.08 -32.23 56.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.139 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 15.5 m-20 -88.78 -2.32 58.53 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.446 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.619 ' HB3' HD12 ' A' ' 35' ' ' ILE . 50.0 m-85 -103.69 152.94 21.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.482 0.658 . . . . 0.0 111.425 -175.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -136.03 161.89 37.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 168.621 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 34' ' ' VAL . 21.1 tp -115.29 148.39 39.26 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.484 -0.487 . . . . 0.0 109.98 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.3 mm? -106.44 134.56 49.39 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.796 ' HB3' HD21 ' A' ' 82' ' ' LEU . 12.6 pt-20 -98.87 87.34 3.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 122.378 1.085 . . . . 0.0 108.665 170.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.615 ' HB2' ' HG3' ' A' ' 79' ' ' GLN . 0.4 OUTLIER -87.07 124.47 33.26 Favored 'General case' 0 N--CA 1.414 -2.255 0 O-C-N 121.656 -0.652 . . . . 0.0 109.757 174.73 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.595 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.6 OUTLIER -113.86 111.25 35.21 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.422 174.054 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 92.5 t -59.17 105.21 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 121.389 0.614 . . . . 0.0 110.046 174.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.49 ' HD2' ' HA ' ' A' ' 65' ' ' LYS . 9.6 mmmt -110.0 102.45 11.18 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.06 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.42 145.42 11.35 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.713 171.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.433 HG21 ' NZ ' ' A' ' 76' ' ' LYS . 4.9 t -139.89 15.88 2.48 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.9 m -57.74 -61.84 2.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.33 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 54.63 -89.38 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.404 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -105.0 -45.17 4.61 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.749 -167.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HG2' ' N ' ' A' ' 72' ' ' THR . 3.8 ttmp? -104.33 164.17 11.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.333 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.431 ' N ' ' HG2' ' A' ' 71' ' ' LYS . 24.1 m -67.46 96.71 0.53 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.324 0.583 . . . . 0.0 109.977 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -137.58 133.84 34.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.714 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 p -66.32 144.48 98.73 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.465 -176.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.11 151.32 73.61 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.867 2.378 . . . . 0.0 112.314 177.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.433 ' NZ ' HG21 ' A' ' 67' ' ' THR . 50.2 mttp -109.99 175.32 5.48 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.727 -176.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.6 p -134.41 110.79 9.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.029 0.443 . . . . 0.0 109.876 176.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.517 ' HB3' HG13 ' A' ' 63' ' ' VAL . 11.9 t -87.6 99.28 11.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.615 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 49.3 tt0 -94.93 131.69 40.58 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.273 -0.422 . . . . 0.0 109.927 -175.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.657 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 27.1 ttt180 -126.72 157.57 38.74 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.899 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -111.99 144.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 118.482 0.583 . . . . 0.0 110.104 177.645 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.963 HD22 ' HG2' ' A' ' 86' ' ' GLU . 16.5 mt -103.17 154.64 19.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.237 0.541 . . . . 0.0 111.575 -173.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.7 mp -87.24 176.0 7.77 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.758 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -47.27 -51.31 19.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.463 0.477 . . . . 0.0 111.475 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -115.03 41.64 2.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.963 ' HG2' HD22 ' A' ' 82' ' ' LEU . 14.1 tp10 -62.34 -28.46 69.77 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.566 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 22.9 m 73.21 122.04 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.482 -175.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.503 ' H ' ' HA ' ' A' ' 30' ' ' THR . 94.0 t -74.68 -36.97 42.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.024 -173.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' A' ' 27' ' ' ARG . 86.7 t80 -73.39 -34.3 65.46 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.545 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 38.4 mt-30 -64.92 -44.73 88.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.87 175.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.479 ' HA ' ' NZ ' ' A' ' 94' ' ' LYS . . . -62.9 -46.69 86.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.039 0.447 . . . . 0.0 110.452 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -56.16 -38.8 71.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.372 -178.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.7 p -74.3 -5.01 39.64 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.479 ' NZ ' ' HA ' ' A' ' 91' ' ' ALA . 10.8 mttp -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.2 0.524 . . . . 0.0 110.643 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.429 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 44.6 m0 -64.41 155.36 32.77 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.871 -173.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.47 ' H ' HG21 ' A' ' 63' ' ' VAL . 98.8 mttt -130.8 18.34 5.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.13 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -163.7 166.79 37.53 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 109.278 -1.529 . . . . 0.0 109.278 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.31 93.27 8.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 118.018 0.909 . . . . 0.0 111.088 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.605 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -100.98 -150.23 23.97 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.206 -0.997 . . . . 0.0 112.024 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.606 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -151.89 155.56 38.35 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 175.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.794 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.5 m-85 -86.52 124.48 32.88 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -102.17 122.09 54.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.801 -0.562 . . . . 0.0 110.397 -174.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.9 tp -75.29 135.49 40.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.5 ttmm -156.86 176.6 12.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.586 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 6.6 mp -104.19 143.98 32.21 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.49 ' N ' HG22 ' A' ' 58' ' ' VAL . 12.1 ptmm? -69.62 -23.52 63.52 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.186 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.817 ' HA ' ' HG2' ' A' ' 110' ' ' GLN . 28.5 mt-10 -83.3 -12.92 56.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.534 177.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.466 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 82.4 mt-30 -94.58 -16.29 23.36 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.899 HG11 HG11 ' A' ' 81' ' ' VAL . 64.4 t -105.21 12.3 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 114.345 -1.298 . . . . 0.0 109.863 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.817 ' HG2' ' HA ' ' A' ' 107' ' ' GLU . 16.7 mm-40 -63.52 167.76 5.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.468 173.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.09 72.41 0.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.585 0.707 . . . . 0.0 110.153 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 64.3 m -87.24 166.82 14.63 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.125 -171.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 113' ' ' ARG . 56.5 mmt-85 -118.87 102.82 9.07 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 67.14 -71.35 0.1 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.014 0.821 . . . . 0.0 110.026 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.91 124.36 10.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 171.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm . . . . . 0 N--CA 1.466 0.343 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.7 -178.666 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.872 0.368 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 m -96.52 27.41 3.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.767 -176.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 47.71 56.58 6.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.938 -167.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.448 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 8.4 mp0 -35.45 114.77 0.27 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.974 177.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.41 ' HB2' ' HD2' ' A' ' 27' ' ' ARG . 5.2 pt-20 -105.1 144.22 32.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.409 -0.814 . . . . 0.0 113.08 -164.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.452 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 54.3 p -119.19 147.81 43.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.109 176.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.936 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.4 p90 -116.51 152.49 33.97 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.426 ' CE2' ' HD3' ' A' ' 24' ' ' LYS . 69.4 m-85 -89.42 131.8 35.3 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.445 -175.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.517 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.8 t -122.33 155.85 27.25 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 176.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.405 ' HB2' HD11 ' A' ' 20' ' ' LEU . 5.1 pm0 -129.46 107.3 9.38 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 163.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -115.04 140.07 38.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.477 -176.77 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -88.42 128.67 35.53 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.863 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -102.09 154.79 18.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.61 75.5 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.34 0.591 . . . . 0.0 110.399 -177.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.469 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 33.3 p -157.8 146.41 14.4 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.271 178.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 15' ' ' SER . 7.4 Cg_exo -74.5 -159.31 0.09 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.866 2.377 . . . . 0.0 112.584 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 71.22 -60.51 0.51 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.84 0.856 . . . . 0.0 110.392 -173.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.474 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.4 tp60 -143.25 100.15 5.32 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.98 -22.19 62.88 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.442 2.761 . . . . 0.0 113.532 -172.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 10' ' ' GLN . 58.9 tp -107.99 137.33 46.17 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.257 -0.277 . . . . 0.0 110.362 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.5 HG22 HG23 ' A' ' 23' ' ' ILE . 20.7 m -112.1 107.94 17.05 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.506 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.3 t -86.43 111.06 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.5 HG23 HG22 ' A' ' 21' ' ' THR . 9.9 pt -125.34 119.09 54.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.957 0.408 . . . . 0.0 111.779 -176.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HD3' ' CE2' ' A' ' 8' ' ' PHE . 21.3 ttpp -79.8 118.51 21.65 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.59 161.84 56.67 Favored Pre-proline 0 C--N 1.318 -0.801 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.665 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 7.5 Cg_exo -62.75 142.51 89.35 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 121.915 1.743 . . . . 0.0 111.907 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.936 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 46.4 mtp180 -63.51 -1.2 1.11 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.49 0.662 . . . . 0.0 110.015 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.4 m -107.9 -11.71 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.204 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.665 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 2.9 m -54.69 124.04 15.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.729 0.776 . . . . 0.0 112.826 176.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.627 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -98.33 177.47 5.36 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.545 171.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.35 -51.43 26.27 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.44 0.462 . . . . 0.0 111.362 -172.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -31.59 72.89 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -42.95 43.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 110.152 -176.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.52 ' CG1' HG21 ' A' ' 88' ' ' VAL . 1.3 p -72.5 -29.2 30.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.696 176.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.566 HD12 ' HB3' ' A' ' 57' ' ' TYR . 5.9 mm -56.51 -57.33 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 171.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.497 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 26.7 tt0 -64.5 -31.43 72.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.934 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 34' ' ' VAL . 6.2 tp60 -63.44 -40.79 98.09 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.145 0.498 . . . . 0.0 109.765 175.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 m -67.92 -32.09 72.3 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.693 175.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.8 mp -61.61 -33.75 74.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.189 0.519 . . . . 0.0 110.727 173.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.6 m -68.9 -39.4 79.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.063 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.488 ' HG3' HG22 ' A' ' 23' ' ' ILE . 74.5 mmtt -78.74 -49.81 12.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.876 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.46 83.75 5.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.716 0.769 . . . . 0.0 109.657 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.597 ' HD2' ' HB2' ' A' ' 44' ' ' TYR . 5.2 tmmm? -148.9 129.37 13.9 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.525 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.953 ' HA ' HD21 ' A' ' 49' ' ' LEU . 6.1 t80 74.51 -35.4 0.3 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 123.892 0.745 . . . . 0.0 110.55 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.8 t -67.5 125.44 26.15 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 172.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.1 t80 64.89 8.93 4.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.666 0.746 . . . . 0.0 109.004 -173.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 37.63 60.95 1.07 Allowed 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.475 -171.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 12.1 tt -82.02 26.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.953 HD21 ' HA ' ' A' ' 44' ' ' TYR . 2.2 mm? -77.64 3.02 14.88 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.183 -173.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -71.14 -18.35 62.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.256 0.55 . . . . 0.0 109.82 176.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -139.3 74.67 34.89 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.2 -175.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -85.87 8.61 4.44 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.631 2.221 . . . . 0.0 110.757 170.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.67 120.82 61.24 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.476 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -96.91 -0.22 1.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.101 2.534 . . . . 0.0 114.158 -176.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 t -75.85 -25.5 56.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.87 0.367 . . . . 0.0 111.151 -173.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.695 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -88.21 2.69 51.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.085 179.216 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.566 ' HB3' HD12 ' A' ' 35' ' ' ILE . 15.9 m-85 -106.31 130.53 54.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.181 -175.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.544 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -113.08 165.57 7.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 168.017 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 101' ' ' PHE . 17.6 tp -118.56 138.38 52.59 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.608 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.4 mm? -98.72 126.55 44.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.792 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.682 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.6 pt-20 -88.81 84.35 6.67 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.621 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 12.7 tt0 -85.77 123.37 31.08 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 119.477 -0.889 . . . . 0.0 108.798 175.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.608 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.01 108.82 25.9 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.738 0.78 . . . . 0.0 110.327 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 78.9 t -77.34 143.76 12.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.558 -173.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.644 ' HZ2' ' HB3' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -133.05 85.25 2.2 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 169.408 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.586 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 5.2 t70 -82.08 -177.64 6.7 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.626 -173.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.461 ' O ' HG23 ' A' ' 67' ' ' THR . 8.9 t -86.59 76.26 9.58 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 122.355 1.074 . . . . 0.0 111.466 -173.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.7 m -68.16 -38.2 81.85 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -73.2 -174.88 1.69 Allowed 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.49 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 40.2 mmtm -142.23 151.43 42.09 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 24.4 ttmm 72.38 -49.89 0.7 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 124.009 0.818 . . . . 0.0 110.667 -173.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -105.65 153.1 22.29 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.625 176.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 10.0 m 68.1 97.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.573 0.545 . . . . 0.0 111.238 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' LYS . 25.7 p -90.07 164.6 27.41 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.959 176.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.586 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 31.3 Cg_exo -58.24 124.79 16.7 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.972 1.781 . . . . 0.0 111.481 177.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.541 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 12.5 mmmm -137.98 145.51 42.03 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.592 -174.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.7 p -123.69 127.85 48.79 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.867 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -109.62 100.67 9.68 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.56 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.8 tt0 -95.05 131.27 41.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -134.35 129.89 36.13 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.576 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -85.86 136.47 22.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.269 -173.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.559 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 22.3 mt -93.63 151.8 19.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.501 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.482 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 7.1 mp -80.2 167.03 20.83 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 163.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -54.63 -31.86 57.99 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.495 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 9.2 pt20 -122.13 39.84 3.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.559 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 8.1 mm-40 -76.92 -7.51 55.69 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.262 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.706 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 12.7 t 70.21 130.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 0.0 111.333 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.627 ' H ' ' HA ' ' A' ' 30' ' ' THR . 93.8 t -78.58 -46.89 24.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 CA-C-O 121.344 0.592 . . . . 0.0 109.768 178.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -72.55 -41.37 65.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.557 -175.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.706 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 6.9 mm100 -63.65 -43.61 96.25 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.345 175.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.88 -49.3 77.18 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.866 0.365 . . . . 0.0 110.436 175.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -57.64 -35.39 70.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.291 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -78.42 -5.96 53.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.012 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.706 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 73.1 mmtt -95.5 -12.64 25.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.227 0.536 . . . . 0.0 110.368 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.454 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 27.2 m0 -57.28 140.21 50.62 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -169.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.608 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.7 mppt? -102.23 38.9 1.58 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.766 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 155.12 -175.5 33.09 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.93 -177.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.557 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.43 108.76 21.31 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.985 0.392 . . . . 0.0 110.168 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -113.46 -150.32 10.54 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.425 -177.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.453 ' HB2' ' HE2' ' A' ' 100' ' ' LYS . 27.8 mtmm -150.25 139.29 21.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.635 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 97.9 m-85 -83.23 146.49 28.55 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.753 -0.779 . . . . 0.0 108.971 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.608 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 80.1 mt -136.23 127.23 42.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 O-C-N 122.182 -0.324 . . . . 0.0 111.376 -172.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.522 ' HG ' HD13 ' A' ' 35' ' ' ILE . 4.7 mp -79.28 109.8 13.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.16 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.519 ' HG2' HG23 ' A' ' 109' ' ' VAL . 33.6 ttpt -139.67 136.93 34.78 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 176.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.56 HD21 ' CE1' ' A' ' 57' ' ' TYR . 18.5 mt -69.17 142.64 54.26 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.461 0.648 . . . . 0.0 112.507 -171.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.4 ptmm? -69.75 -30.98 68.7 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.427 -1.261 . . . . 0.0 110.084 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.421 ' OE1' ' HG3' ' A' ' 106' ' ' LYS . 5.0 mm-40 -68.16 -19.05 64.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.132 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -109.93 -10.6 14.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.539 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.571 HG11 HG11 ' A' ' 81' ' ' VAL . 0.9 OUTLIER -92.56 -33.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.125 -179.413 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 10.9 mm-40 -56.66 85.4 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.319 0 O-C-N 123.836 0.71 . . . . 0.0 112.831 -172.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.98 1.52 6.57 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.056 -0.975 . . . . 0.0 108.559 170.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.1 m -88.48 78.32 7.89 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.145 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.55 ' HB2' ' OE1' ' A' ' 114' ' ' GLU . 43.3 mtm180 -85.56 -59.74 2.23 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 173.01 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.55 ' OE1' ' HB2' ' A' ' 113' ' ' ARG . 4.1 mp0 -68.74 -48.61 63.33 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.266 -1.334 . . . . 0.0 109.797 175.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -70.86 151.48 44.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.828 174.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.511 ' HA ' ' HE3' ' A' ' 116' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.011 -176.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.626 0.251 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 p -167.54 174.92 7.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.49 -174.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -72.88 -33.6 66.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 176.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -84.49 137.45 33.34 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 170.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 36.8 tt0 -102.81 139.17 38.74 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m -104.2 148.29 26.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.664 0.745 . . . . 0.0 111.755 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.863 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 16.5 p90 -115.78 149.84 37.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.598 -1.183 . . . . 0.0 107.896 176.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -82.73 119.8 24.78 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.563 -173.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.609 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.7 t -108.72 130.98 60.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.652 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.456 ' HG2' HG22 ' A' ' 22' ' ' VAL . 45.9 mt-30 -104.15 109.01 20.65 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 164.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.637 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.5 p -129.23 121.65 54.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.066 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.613 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 91.1 m-70 -71.45 150.6 44.76 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.039 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -96.79 -164.95 1.2 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.074 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.4 p -118.13 10.66 7.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 122.11 0.957 . . . . 0.0 108.79 173.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -108.06 153.41 41.78 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.631 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -85.68 -175.38 1.88 Allowed 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.677 2.251 . . . . 0.0 112.59 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 72.93 -56.67 0.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.812 0.845 . . . . 0.0 110.542 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -123.52 87.4 52.12 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 172.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -83.12 9.13 4.22 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 123.112 2.541 . . . . 0.0 112.841 -174.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.577 ' HA ' ' HA ' ' A' ' 12' ' ' HIS . 64.6 tp -143.47 124.98 14.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.738 0.304 . . . . 0.0 110.823 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.5 m -94.81 124.89 39.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.528 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.456 HG22 ' HG2' ' A' ' 10' ' ' GLN . 46.8 t -102.86 112.92 38.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 171.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.609 HG13 ' HB ' ' A' ' 9' ' ' VAL . 3.1 pt -128.3 168.25 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.132 0.492 . . . . 0.0 111.626 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -117.85 96.98 5.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.69 157.65 33.33 Favored Pre-proline 0 CA--C 1.499 -0.998 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.736 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.9 Cg_exo -63.7 140.48 74.67 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 121.587 1.525 . . . . 0.0 111.436 -174.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.863 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 59.4 mtp180 -62.88 -0.74 0.72 Allowed 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 121.296 0.569 . . . . 0.0 110.421 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' A' ' 26' ' ' PRO . 32.9 m -114.57 -7.16 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.763 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.736 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -59.48 135.07 57.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.124 0.487 . . . . 0.0 110.707 177.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 9.7 p -99.62 -168.29 1.58 Allowed 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.453 ' HA ' ' CG1' ' A' ' 88' ' ' VAL . . . -60.54 -50.28 74.19 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.922 -176.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.653 ' HG2' ' HB2' ' A' ' 84' ' ' ASP . 0.1 OUTLIER -59.03 -30.97 68.42 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.736 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -73.75 -52.89 11.68 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.931 0.872 . . . . 0.0 109.824 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.427 HG11 HG11 ' A' ' 88' ' ' VAL . 6.8 p -66.11 -28.14 42.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.679 -1.6 . . . . 0.0 110.3 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.499 HD13 ' HG ' ' A' ' 103' ' ' LEU . 2.3 mm -55.87 -56.21 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.389 171.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.589 ' HG2' ' HG3' ' A' ' 54' ' ' PRO . 40.9 mt-30 -64.33 -32.22 73.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.183 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -61.27 -39.02 88.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.049 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.3 m -67.88 -38.81 83.49 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.977 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -55.56 -38.6 69.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.639 174.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.64 -45.62 89.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.133 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -70.8 -35.65 72.63 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.787 0.327 . . . . 0.0 110.942 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.48 12.86 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.683 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.413 ' HA ' HD11 ' A' ' 49' ' ' LEU . 7.8 ttpm? -69.88 120.88 16.29 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.745 ' HA ' HD21 ' A' ' 49' ' ' LEU . 89.0 m-85 62.77 -126.66 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 O-C-N 123.843 0.714 . . . . 0.0 109.297 -169.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.7 m 64.83 -87.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.017 0.527 . . . . 0.0 111.517 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -112.05 19.56 17.71 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.631 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 17.6 p 51.46 78.58 0.11 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.463 -176.216 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.529 HG22 ' O ' ' A' ' 48' ' ' ILE . 4.2 mp -94.75 14.45 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.348 174.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.745 HD21 ' HA ' ' A' ' 44' ' ' TYR . 1.4 mm? -78.82 7.25 7.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.231 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t -71.08 -29.59 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.102 177.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -139.9 79.31 23.23 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.081 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -81.52 0.23 10.04 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.062 2.508 . . . . 0.0 112.096 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -98.18 121.08 58.24 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.607 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.589 ' HG3' ' HG2' ' A' ' 36' ' ' GLN . 86.3 Cg_endo -82.04 -5.93 12.15 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.049 2.499 . . . . 0.0 113.338 -171.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.0 m -65.31 -12.71 54.6 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.053 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 27.2 m-20 -98.68 8.74 44.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.282 0.563 . . . . 0.0 110.35 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.565 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 42.1 m-85 -118.02 139.01 51.81 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.168 -174.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.718 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -104.99 178.9 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 162.062 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.582 ' HB3' HD12 ' A' ' 82' ' ' LEU . 21.0 tp -134.83 145.71 48.58 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.696 ' O ' ' HA ' ' A' ' 101' ' ' PHE . 2.6 mm? -102.05 126.92 49.11 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.622 ' HG2' ' HB3' ' A' ' 80' ' ' ARG . 11.2 pt-20 -92.32 83.75 5.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.491 1.139 . . . . 0.0 108.202 169.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.627 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -86.7 125.42 33.87 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.501 -0.75 . . . . 0.0 110.082 176.478 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.601 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.9 OUTLIER -117.54 111.33 34.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.28 0.562 . . . . 0.0 110.364 175.176 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.556 HG23 ' OE2' ' A' ' 62' ' ' GLU . 88.9 t -72.29 104.31 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.577 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -85.05 84.5 7.69 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 170.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -73.06 151.4 41.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.289 -172.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.461 HG21 ' HB ' ' A' ' 73' ' ' THR . 0.2 OUTLIER -71.02 -14.98 62.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.407 -175.113 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.5 m 60.07 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.594 0.758 . . . . 0.0 112.673 172.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -35.53 80.36 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.433 0.635 . . . . 0.0 110.153 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -104.15 86.22 2.52 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.068 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.816 ' HE2' ' HA ' ' A' ' 71' ' ' LYS . 8.2 mmpt? -74.01 -19.6 60.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.026 0.441 . . . . 0.0 110.705 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.4 t -79.57 -4.27 50.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.252 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.461 ' HB ' HG21 ' A' ' 67' ' ' THR . 23.0 m -112.73 125.62 54.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.548 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.452 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 36.2 p -50.43 136.5 23.8 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.851 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 13.8 Cg_exo -68.09 165.15 29.34 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 123.03 2.487 . . . . 0.0 111.407 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmm -116.29 95.64 5.17 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.465 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.52 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 15.0 m -83.61 106.6 15.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.455 0.645 . . . . 0.0 110.613 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -89.85 99.87 12.8 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.483 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.598 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 48.8 tt0 -94.36 131.57 39.87 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.622 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 50.2 ttt180 -127.44 149.73 49.96 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.792 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -111.86 135.07 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 118.959 0.799 . . . . 0.0 111.498 -175.627 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.582 HD12 ' HB3' ' A' ' 59' ' ' LEU . 35.2 mt -89.99 -161.58 0.8 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.802 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.464 ' HB3' ' OE2' ' A' ' 86' ' ' GLU . 37.0 tp -131.93 -51.68 0.97 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.839 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.653 ' HB2' ' HG2' ' A' ' 32' ' ' GLN . 17.7 p-10 177.34 -38.36 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.41 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.426 ' HG3' ' CG ' ' A' ' 84' ' ' ASP . 40.9 mt-30 -118.3 19.22 13.52 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -174.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.464 ' OE2' ' HB3' ' A' ' 83' ' ' LEU . 9.0 mp0 -62.69 -6.63 3.76 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -177.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.474 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 90.4 m 67.84 96.26 0.06 Allowed 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.531 0.52 . . . . 0.0 110.018 -176.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 31' ' ' ALA . 17.9 m -68.92 -27.21 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.282 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -71.42 -39.25 71.19 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.137 -1.025 . . . . 0.0 108.991 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 39.2 mm-40 -68.05 -43.33 78.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.576 176.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.7 79.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.455 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.9 -30.89 69.33 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.089 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.3 t -77.67 -19.67 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.514 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 31.5 mmtp -75.23 -23.86 57.61 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.956 0.407 . . . . 0.0 110.367 177.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.3 m0 -58.92 158.34 8.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -171.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.425 ' H ' HG21 ' A' ' 63' ' ' VAL . 11.6 mptt -131.03 23.13 4.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 113.815 -1.539 . . . . 0.0 109.376 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -169.04 174.29 43.54 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -93.77 98.33 11.02 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 117.458 0.629 . . . . 0.0 110.99 -177.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.645 ' O ' ' HG3' ' A' ' 100' ' ' LYS . . . -106.53 -152.54 19.46 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.784 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 10.1 mtmm -156.39 149.63 24.35 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.696 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 94.4 m-85 -82.9 151.02 26.14 Favored 'General case' 0 C--N 1.312 -1.03 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.163 169.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.521 HG13 ' HB2' ' A' ' 12' ' ' HIS . 4.4 mp -130.58 125.56 59.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 121.959 -0.463 . . . . 0.0 110.62 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.499 ' HG ' HD13 ' A' ' 35' ' ' ILE . 1.9 mp -71.05 131.2 43.28 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -154.99 170.15 22.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.3 mp -96.15 145.18 25.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.493 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.718 ' HB3' HG13 ' A' ' 58' ' ' VAL . 15.7 ptpt -82.3 -12.52 57.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.935 0.874 . . . . 0.0 110.043 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -89.95 -2.08 58.09 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.062 170.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -108.15 -41.19 4.98 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.792 HG11 HG11 ' A' ' 81' ' ' VAL . 55.1 t -91.94 105.97 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.574 170.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.678 ' HG3' ' HB3' ' A' ' 112' ' ' SER . 2.7 pt20 -145.4 -176.91 5.3 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.584 -174.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -81.07 66.82 6.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.678 ' HB3' ' HG3' ' A' ' 110' ' ' GLN . 83.8 p -105.26 -168.53 1.48 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.492 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.562 ' CZ ' ' HA ' ' A' ' 113' ' ' ARG . 0.6 OUTLIER -99.09 71.14 1.82 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.052 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.636 ' HG2' ' H ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -110.25 -31.48 7.3 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.243 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 63.15 26.18 15.18 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.42 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.636 ' H ' ' HG2' ' A' ' 114' ' ' GLU . 57.6 tttm . . . . . 0 C--O 1.235 0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.253 178.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.796 0.331 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 m -88.82 82.5 6.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -131.85 4.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.283 -173.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -120.1 124.67 46.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.116 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.832 ' HG2' ' HD3' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -102.53 121.33 42.14 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.27 177.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 p -99.89 140.79 33.6 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.626 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.862 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.0 p90 -105.91 154.73 20.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -84.9 128.67 34.72 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.162 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.498 HG22 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -122.17 128.89 75.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.072 175.005 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.463 ' HB3' HD22 ' A' ' 20' ' ' LEU . 47.1 mt-30 -100.65 106.01 17.43 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 165.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.658 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -115.69 112.49 39.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.301 -169.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.452 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 21.5 m-70 -62.11 139.88 58.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.156 0.503 . . . . 0.0 112.169 -173.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 46' ' ' TYR . 18.1 t70 -86.67 169.73 12.43 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 165.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.462 ' HB ' ' CD2' ' A' ' 46' ' ' TYR . 16.9 t -81.89 -23.89 9.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.549 -178.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.729 ' HB3' ' HD1' ' A' ' 46' ' ' TYR . 79.0 p -92.44 142.01 25.44 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.821 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.4 -9.55 26.3 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.453 2.102 . . . . 0.0 111.764 173.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -60.44 -33.59 72.76 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 174.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -123.88 92.98 47.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.419 170.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -62.42 -18.26 62.09 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.156 2.571 . . . . 0.0 112.737 -175.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.561 HD11 ' HD3' ' A' ' 100' ' ' LYS . 5.7 mt -163.88 125.24 2.31 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.376 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.438 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 18.8 m -93.52 108.56 20.24 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.424 175.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.5 p -92.51 119.61 40.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.438 0.637 . . . . 0.0 110.569 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 24.5 pt -128.78 144.13 39.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.345 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -98.32 95.39 7.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 170.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.63 165.17 14.21 Favored Pre-proline 0 CA--C 1.506 -0.744 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.701 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.643 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 6.1 Cg_exo -68.65 139.89 45.57 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 122.015 1.81 . . . . 0.0 112.129 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.862 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.8 mtp180 -61.76 -8.66 5.03 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.1 m -99.09 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.604 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.643 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 15.9 m -60.87 120.43 10.15 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.433 0.635 . . . . 0.0 111.5 174.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.524 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -100.0 179.07 4.61 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.35 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.624 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.2 -52.44 20.88 Favored 'General case' 0 C--O 1.216 -0.684 0 O-C-N 123.592 0.557 . . . . 0.0 111.697 -170.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.415 ' OE1' ' HB2' ' A' ' 54' ' ' PRO . 1.0 OUTLIER -63.86 -31.88 73.21 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -177.323 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.78 -50.34 21.05 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.8 0.81 . . . . 0.0 109.678 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.636 HG11 HD22 ' A' ' 59' ' ' LEU . 1.4 p -66.6 -27.9 41.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.442 179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 31' ' ' ALA . 5.6 mm -56.23 -57.55 8.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.078 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.554 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 41.8 tt0 -67.26 -35.1 78.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -178.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -59.47 -43.6 93.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 120.892 0.377 . . . . 0.0 110.657 175.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.3 m -71.16 -31.63 67.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.046 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 4.8 mp -55.91 -39.61 71.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.198 0.523 . . . . 0.0 110.384 171.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.3 m -72.61 -29.7 63.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.012 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -75.08 -41.1 59.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.401 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.09 44.99 0.8 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.375 0.607 . . . . 0.0 110.509 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.527 ' O ' HD11 ' A' ' 49' ' ' LEU . 6.9 ttpm? -61.94 -30.57 71.0 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.14 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -148.99 0.85 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 m -52.8 -81.43 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.767 0.318 . . . . 0.0 111.725 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.729 ' HD1' ' HB3' ' A' ' 15' ' ' SER . 70.2 t80 -90.88 19.45 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.9 p 48.73 55.32 9.3 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.65 -171.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mt -75.83 71.07 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 122.717 1.246 . . . . 0.0 108.44 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.527 HD11 ' O ' ' A' ' 43' ' ' LYS . 14.4 mt -124.41 -28.68 3.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.164 -1.835 . . . . 0.0 108.42 -176.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -76.79 123.08 25.68 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 163.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 65.66 68.69 0.66 Allowed Pre-proline 0 N--CA 1.467 0.419 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -168.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -85.45 9.25 4.18 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.084 2.523 . . . . 0.0 111.213 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -97.83 124.57 47.52 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.928 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.415 ' HB2' ' OE1' ' A' ' 32' ' ' GLN . 66.8 Cg_endo -74.71 -10.53 21.75 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.793 2.329 . . . . 0.0 113.19 -173.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.567 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 70.1 m -85.69 8.77 18.42 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -175.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 79.1 m-20 -109.42 -2.15 17.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.305 0.574 . . . . 0.0 109.701 169.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.588 ' HB3' HD12 ' A' ' 35' ' ' ILE . 33.4 m-85 -108.26 154.97 21.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.753 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.72 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.25 155.6 37.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 169.439 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.636 HD22 HG11 ' A' ' 34' ' ' VAL . 22.8 tp -103.1 146.75 27.91 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.991 0.425 . . . . 0.0 110.009 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' A' ' 81' ' ' VAL . 2.1 mm? -106.81 125.45 51.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.881 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.651 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.6 pt-20 -87.76 82.67 7.29 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.3 1.048 . . . . 0.0 108.271 170.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.552 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -87.4 123.55 32.47 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 121.555 -0.716 . . . . 0.0 109.7 176.663 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.736 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.3 OUTLIER -119.39 118.11 56.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.107 178.801 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.587 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 63.3 t -79.93 109.79 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.396 177.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -91.19 92.55 8.71 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 172.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -71.06 152.71 43.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.501 -174.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.479 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.0 t -119.79 149.05 42.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.09 -175.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 m -76.48 -5.82 49.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.43 0.633 . . . . 0.0 110.417 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -78.26 0.75 24.05 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.896 -177.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 67' ' ' THR . 37.1 mtmm -52.65 98.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -170.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -148.28 -61.59 0.25 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 m -111.24 -27.42 8.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.741 -1.118 . . . . 0.0 108.464 170.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.4 m -84.02 121.58 27.59 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.394 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 21.5 p -90.61 159.35 41.21 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.93 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.38 147.53 56.36 Favored 'Trans proline' 0 CA--C 1.507 -0.855 0 C-N-CA 122.907 2.405 . . . . 0.0 112.107 176.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.656 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -113.43 100.32 8.44 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 113.852 -1.522 . . . . 0.0 111.516 -164.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.587 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 13.4 p -72.79 129.34 37.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.75 176.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.8 m -111.21 107.25 16.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.538 ' HG2' HD12 ' A' ' 60' ' ' LEU . 51.8 tt0 -93.8 131.03 39.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.88 0.371 . . . . 0.0 110.18 -172.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.519 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 55.2 ttt180 -128.01 151.62 48.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.827 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -106.18 144.28 15.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.99 -178.584 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.632 HD21 ' HB3' ' A' ' 61' ' ' GLU . 22.4 mt -101.71 150.88 22.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.566 -175.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 2.8 mm? -88.72 -173.49 4.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.151 170.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.23 -50.69 70.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 111.238 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -116.14 40.12 2.92 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.645 -177.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.463 ' HB2' ' H ' ' A' ' 83' ' ' LEU . 30.2 tp10 -76.1 -11.37 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 175.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 67.1 m 65.0 126.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 114.6 -1.182 . . . . 0.0 112.623 172.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.524 ' H ' ' HA ' ' A' ' 30' ' ' THR . 64.6 t -76.03 -42.26 38.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.559 -174.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -72.26 -38.61 68.8 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.635 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -62.06 -42.1 98.84 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.87 174.822 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.529 ' HA ' ' CE ' ' A' ' 94' ' ' LYS . . . -60.5 -43.95 96.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.638 176.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -61.17 -31.75 71.49 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.546 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.1 t -77.12 -13.84 59.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.111 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 64.4 mttt -85.1 -18.27 34.78 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.493 0.663 . . . . 0.0 110.285 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.503 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.9 m0 -62.32 145.79 52.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.355 -170.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.736 ' H ' HG21 ' A' ' 63' ' ' VAL . 20.5 mttp -115.41 23.8 12.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.754 -1.566 . . . . 0.0 108.169 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 175.89 -171.44 44.49 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-N 114.072 -1.422 . . . . 0.0 110.227 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.11 108.56 20.01 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 117.304 0.552 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.572 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -114.85 -151.02 10.05 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.829 -177.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.561 ' HD3' HD11 ' A' ' 20' ' ' LEU . 1.1 mtmp? -150.46 149.56 30.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.658 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -91.2 124.08 35.14 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.874 168.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.0 mp -111.5 129.44 66.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.304 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.567 ' HG ' HD13 ' A' ' 35' ' ' ILE . 3.8 mp -77.98 131.08 37.24 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.892 175.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.559 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.0 ttmm -145.87 -177.1 5.41 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 4.7 mp -106.57 135.71 47.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.92 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.72 ' HB3' HG13 ' A' ' 58' ' ' VAL . 16.5 ptmt -69.92 -31.88 69.88 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.344 -177.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.6 ' HA ' ' HG2' ' A' ' 110' ' ' GLN . 12.0 pt-20 -74.7 -15.77 60.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -95.49 -23.9 16.9 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.827 HG11 HG11 ' A' ' 81' ' ' VAL . 55.8 t -86.31 8.72 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.519 175.142 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.6 ' HG2' ' HA ' ' A' ' 107' ' ' GLU . 28.2 mm-40 -75.95 51.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 171.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.88 -10.24 59.26 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.453 -176.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 32.6 m -128.0 -35.5 2.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.93 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.581 ' O ' ' HB3' ' A' ' 110' ' ' GLN . 36.0 ttt180 -103.2 109.11 20.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.091 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -98.52 -72.71 0.64 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.419 ' CG ' ' H ' ' A' ' 116' ' ' LYS . 8.0 t70 -175.73 -159.51 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.419 ' H ' ' CG ' ' A' ' 115' ' ' ASP . 38.4 pttt . . . . . 0 C--N 1.324 -0.532 0 CA-C-O 120.578 0.228 . . . . 0.0 110.979 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 121.126 0.489 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.5 t -179.54 77.78 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -93.02 -11.7 32.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.008 -169.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.536 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 1.9 pm0 -84.34 148.41 26.66 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.052 174.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -121.7 117.28 26.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.717 0.77 . . . . 0.0 111.953 -174.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.614 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 7.9 p -123.05 139.75 53.74 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.4 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.771 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 18.0 p90 -107.26 148.3 29.13 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -79.59 131.7 36.08 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.758 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.49 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.9 t -122.81 142.64 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.571 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.427 ' HB3' HD11 ' A' ' 20' ' ' LEU . 46.5 mt-30 -111.56 107.07 16.11 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 167.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.528 ' HB ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -122.63 139.65 48.86 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -175.917 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.693 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 92.5 m-70 -89.74 121.05 31.54 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.951 177.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.41 172.78 6.63 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 172.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.46 39.19 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 111.372 -170.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.713 ' HA ' ' HB2' ' A' ' 46' ' ' TYR . 36.7 m -115.15 151.8 46.08 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.449 . . . . 0.0 111.159 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.503 ' HD3' ' CD1' ' A' ' 46' ' ' TYR . 89.5 Cg_endo -94.43 -11.85 1.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.301 2.667 . . . . 0.0 112.892 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.53 -24.79 59.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.001 0.429 . . . . 0.0 110.428 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -149.81 95.47 3.68 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.77 -44.72 38.34 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.607 2.204 . . . . 0.0 111.737 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.427 HD11 ' HB3' ' A' ' 10' ' ' GLN . 64.8 tp -107.53 100.27 9.7 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.26 108.76 7.24 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.489 -179.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.25 123.07 47.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 121.981 -0.449 . . . . 0.0 109.925 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.3 pt -130.36 175.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.147 0.499 . . . . 0.0 110.776 -178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 44.0 tttp -132.06 96.98 4.03 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 171.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.91 158.21 32.23 Favored Pre-proline 0 CA--C 1.5 -0.948 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.527 -176.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.712 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 8.1 Cg_exo -61.59 141.76 92.4 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.93 1.753 . . . . 0.0 111.625 -174.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.771 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.6 mtp-105 -61.79 -2.36 0.82 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.872 0.844 . . . . 0.0 110.235 -179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' A' ' 26' ' ' PRO . 3.4 p -107.67 -21.95 5.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.413 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.712 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 98.8 p -56.18 127.76 32.28 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 120.93 0.395 . . . . 0.0 110.353 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.495 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 7.7 p -95.27 -166.51 1.47 Allowed 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.477 ' HB2' HD13 ' A' ' 82' ' ' LEU . . . -59.26 -50.05 75.5 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.042 -177.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -60.72 -31.83 71.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 -178.067 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -73.29 -53.16 11.52 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 122.128 0.966 . . . . 0.0 109.797 -176.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.562 HG11 HG11 ' A' ' 88' ' ' VAL . 5.4 p -65.96 -27.96 42.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 113.771 -1.558 . . . . 0.0 110.29 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.548 HD12 ' HB3' ' A' ' 57' ' ' TYR . 4.3 mm -56.42 -56.52 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.134 170.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 34.6 tt0 -69.63 -33.4 72.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.384 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -62.03 -36.11 80.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.012 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.2 m -69.33 -37.3 77.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.899 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 7.4 mp -53.65 -44.21 69.41 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.157 0.503 . . . . 0.0 110.101 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.514 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 48.9 t -63.39 -36.19 82.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.08 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.34 -12.01 58.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.755 0.312 . . . . 0.0 111.56 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.32 17.07 14.76 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' A' ' 40' ' ' CYS . 0.9 OUTLIER -73.46 11.64 0.75 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -178.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.596 ' HA ' ' HA ' ' A' ' 47' ' ' SER . 27.7 p90 -167.38 4.94 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.544 167.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 t -62.0 -68.79 0.29 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.756 0.312 . . . . 0.0 110.473 -175.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.713 ' HB2' ' HA ' ' A' ' 15' ' ' SER . 32.5 t80 -90.95 18.79 6.23 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 167.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.596 ' HA ' ' HA ' ' A' ' 44' ' ' TYR . 12.0 m 58.03 50.49 10.07 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.38 -172.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.419 HD11 ' HD2' ' A' ' 46' ' ' TYR . 39.9 mm -81.51 68.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.534 0.683 . . . . 0.0 109.381 175.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 44' ' ' TYR . 5.7 mp -104.32 -6.5 20.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.481 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.9 m -77.95 -24.48 48.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.612 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -122.47 101.48 40.43 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.358 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -101.47 14.14 0.38 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.406 2.737 . . . . 0.0 113.034 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -131.16 116.14 16.58 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 122.143 0.973 . . . . 0.0 111.34 -177.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -80.06 8.13 4.26 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 123.024 2.483 . . . . 0.0 112.437 -175.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 p -73.17 -3.62 27.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.784 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 m-20 -107.81 -3.38 19.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.36 176.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.548 ' HB3' HD12 ' A' ' 35' ' ' ILE . 35.4 m-85 -103.56 145.82 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.829 -171.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.602 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -135.33 151.98 31.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.608 165.166 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.824 HD21 ' HB3' ' A' ' 101' ' ' PHE . 32.5 tp -104.51 147.17 27.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.041 0.448 . . . . 0.0 111.274 -174.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.573 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -102.84 124.9 49.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.732 176.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.667 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.5 pt-20 -88.82 87.31 7.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.232 1.015 . . . . 0.0 108.569 170.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.662 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 1.3 tt0 -85.86 124.47 32.37 Favored 'General case' 0 N--CA 1.426 -1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 109.685 175.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.57 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -118.18 113.8 43.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-O 121.188 0.518 . . . . 0.0 110.159 175.757 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.576 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t -77.78 110.1 13.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.593 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.466 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 8.9 ptpp? -98.91 90.84 4.79 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 171.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -104.6 171.27 7.42 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.731 -175.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.8 t -144.67 117.73 8.87 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.891 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.7 m -88.57 -7.6 56.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.572 0.701 . . . . 0.0 110.063 -175.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -101.75 -59.01 1.77 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 -178.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -82.17 82.65 7.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.206 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 71' ' ' LYS . 1.6 mmmp? -80.99 17.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -174.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.4 t -65.46 -18.94 65.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -134.36 151.22 51.09 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.478 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.5 p -82.0 163.53 52.81 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.931 175.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.99 126.23 21.54 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 121.86 1.707 . . . . 0.0 110.925 174.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -108.92 99.84 9.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.628 -171.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.576 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.2 p -73.77 103.34 4.29 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.653 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.7 m -86.51 101.0 12.78 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.525 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.597 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 33.2 tt0 -93.91 129.86 40.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.86 -175.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.474 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 38.5 ttt-85 -125.84 147.38 49.46 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.944 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -101.65 143.24 14.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.362 178.89 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.563 HD22 ' HB3' ' A' ' 86' ' ' GLU . 45.3 mt -98.57 162.96 12.86 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.609 -176.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.588 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 58.6 mt -84.65 174.68 9.76 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 166.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.428 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 11.3 m-20 -55.05 -44.24 74.55 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.911 0.386 . . . . 0.0 110.546 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -121.35 53.36 1.17 Allowed 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.629 0.252 . . . . 0.0 111.374 176.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.588 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.2 OUTLIER -75.04 -4.29 37.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.559 174.283 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.495 ' HA ' ' HB ' ' A' ' 30' ' ' THR . 47.1 m 64.39 105.72 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.179 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.563 HG11 HD23 ' A' ' 59' ' ' LEU . 17.9 m -74.39 -27.37 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 O-C-N 122.311 -0.243 . . . . 0.0 111.585 -178.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -70.82 -38.58 73.27 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.459 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -63.65 -48.28 77.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.074 175.604 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.52 -50.51 67.69 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.401 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.502 ' OE1' ' HE2' ' A' ' 7' ' ' PHE . 20.8 tt0 -63.63 -37.18 86.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.707 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.4 p -75.4 -10.36 59.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.532 0.682 . . . . 0.0 110.263 176.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -101.94 -0.43 33.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.646 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.441 ' C ' ' HD3' ' A' ' 96' ' ' LYS . 40.3 m0 -75.62 158.42 32.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 122.131 0.967 . . . . 0.0 112.78 175.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.518 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.8 mppt? -126.94 29.87 5.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 113.466 -1.697 . . . . 0.0 109.228 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -175.36 -153.01 9.81 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.887 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -121.22 104.39 9.7 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.825 0.345 . . . . 0.0 110.248 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.662 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -114.56 -154.46 10.9 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.075 -1.059 . . . . 0.0 113.112 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.693 ' HD2' ' NE2' ' A' ' 12' ' ' HIS . 4.8 mtmp? -151.77 137.3 17.75 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.352 0.661 . . . . 0.0 109.76 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.824 ' HB3' HD21 ' A' ' 59' ' ' LEU . 92.3 m-85 -81.21 119.56 23.77 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.878 174.168 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 58.2 mt -110.26 120.16 60.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 O-C-N 121.993 -0.442 . . . . 0.0 111.122 -172.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.651 HD12 HD13 ' A' ' 59' ' ' LEU . 1.6 mp -71.08 128.55 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.394 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.512 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 18.3 ttmm -144.71 -177.76 5.67 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 175.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.548 ' HB3' ' HG3' ' A' ' 107' ' ' GLU . 38.7 mt -110.05 149.61 29.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.641 0.734 . . . . 0.0 111.852 -179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 19.0 ptmt -87.31 -12.31 46.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.136 -179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.548 ' HG3' ' HB3' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -79.79 -5.89 56.24 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.315 169.5 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.465 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 47.8 mt-30 -107.54 -51.07 2.96 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.944 HG11 HG11 ' A' ' 81' ' ' VAL . 91.6 t -84.01 90.1 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-N 114.116 -1.402 . . . . 0.0 109.969 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.458 ' C ' ' H ' ' A' ' 112' ' ' SER . 3.8 pt20 -131.16 44.58 2.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.544 -176.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 68.52 -11.66 0.39 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.126 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.458 ' H ' ' C ' ' A' ' 110' ' ' GLN . 92.2 p 57.71 174.86 0.05 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.593 1.157 . . . . 0.0 112.55 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.73 -24.15 11.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -71.16 -30.31 66.29 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.127 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.65 114.6 3.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.971 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.546 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.475 0.781 0 CA-C-O 120.712 0.291 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.452 ' O ' ' HB2' ' A' ' 27' ' ' ARG . 66.6 m -139.59 5.37 2.21 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.133 0.492 . . . . 0.0 111.495 -179.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -86.07 -10.56 54.74 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.632 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -102.09 5.9 40.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.486 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -129.92 147.38 51.67 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.096 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.563 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 9.8 p -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.073 0.463 . . . . 0.0 109.972 176.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.91 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.6 p90 -104.75 154.03 20.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -83.95 137.95 33.38 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.65 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.582 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.1 t -128.23 139.52 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.828 0.347 . . . . 0.0 110.265 176.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -107.58 106.29 16.57 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 165.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.69 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -116.45 134.38 60.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.698 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -89.35 146.16 24.87 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.96 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -97.64 -167.3 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.8 t -108.01 -15.06 9.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 176.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.421 ' HB3' ' CE2' ' A' ' 46' ' ' TYR . 1.3 m -96.63 151.97 38.27 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.108 -175.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.424 ' O ' ' HB3' ' A' ' 17' ' ' GLU . 8.8 Cg_exo -72.57 -174.98 1.63 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.989 2.459 . . . . 0.0 111.772 175.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 16' ' ' PRO . 11.4 tp10 72.77 -42.72 0.54 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.237 0.615 . . . . 0.0 110.559 -176.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -122.92 71.57 42.22 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.391 175.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.424 ' HD3' ' C ' ' A' ' 17' ' ' GLU . 22.8 Cg_exo -64.57 -39.33 28.16 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.307 2.005 . . . . 0.0 110.708 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -120.49 114.14 21.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.022 174.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -92.14 109.94 21.31 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.336 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.9 p -91.82 112.74 26.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.782 0.801 . . . . 0.0 110.553 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.414 HG13 ' HB ' ' A' ' 9' ' ' VAL . 6.8 pt -121.17 171.19 10.2 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.741 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 41.5 tttp -129.25 96.12 4.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 172.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.22 161.57 22.5 Favored Pre-proline 0 CA--C 1.507 -0.706 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.324 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.956 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.9 Cg_exo -64.91 143.35 79.15 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 121.779 1.653 . . . . 0.0 111.817 -172.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.91 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 58.5 mtp85 -63.23 -1.68 1.13 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.317 0.579 . . . . 0.0 110.48 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.442 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.6 m -118.69 -0.88 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.524 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.956 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 84.4 p -59.89 139.09 57.61 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.132 0.491 . . . . 0.0 110.846 175.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.551 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -107.35 179.22 4.31 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.523 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.99 -48.97 61.22 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 123.206 0.316 . . . . 0.0 111.495 -175.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.431 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -59.65 -32.54 70.55 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.539 0.209 . . . . 0.0 110.911 -179.177 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.66 -54.18 9.75 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.059 0.933 . . . . 0.0 109.973 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.566 ' CG1' HD22 ' A' ' 59' ' ' LEU . 9.8 p -64.57 -27.34 42.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.748 -1.569 . . . . 0.0 109.849 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.647 HD13 HD12 ' A' ' 103' ' ' LEU . 6.1 mm -56.97 -56.15 16.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.066 167.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.9 tm0? -67.2 -34.64 77.93 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.791 -175.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -65.53 -48.95 70.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.477 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.456 ' HB ' HD13 ' A' ' 103' ' ' LEU . 20.6 m -63.68 -39.25 93.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.331 0.586 . . . . 0.0 110.14 178.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.45 -43.81 93.1 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.716 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.9 t -62.39 -33.98 75.82 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.734 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -75.33 -43.45 50.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.815 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.859 ' HB1' HD12 ' A' ' 48' ' ' ILE . . . -69.92 -7.12 37.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.444 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.665 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 25.0 ttpp -68.13 -11.32 58.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.101 0.476 . . . . 0.0 109.912 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -140.95 -24.11 0.76 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.388 172.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.676 ' HB3' ' HA ' ' A' ' 42' ' ' ALA . 13.0 t -65.77 115.15 5.6 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.421 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 71.3 t80 66.36 4.14 3.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.945 0.879 . . . . 0.0 108.904 -173.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.437 ' C ' HD12 ' A' ' 49' ' ' LEU . 3.0 m 44.93 69.73 0.41 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 113.899 -1.5 . . . . 0.0 111.679 -173.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.859 HD12 ' HB1' ' A' ' 42' ' ' ALA . 50.7 mt -76.95 -67.57 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.563 173.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' A' ' 43' ' ' LYS . 4.1 mp 67.19 -47.5 0.48 Allowed 'General case' 0 N--CA 1.473 0.695 0 O-C-N 124.022 0.827 . . . . 0.0 112.98 176.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.0 m -53.81 130.66 37.76 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.746 0.419 . . . . 0.0 111.469 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 55.72 72.25 1.07 Allowed Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.287 -176.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -84.71 7.61 5.09 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.008 2.472 . . . . 0.0 111.535 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.42 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 1.6 p-10 -91.16 116.95 67.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.467 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 84.0 Cg_endo -85.53 2.23 7.81 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.082 2.521 . . . . 0.0 112.941 -171.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.9 p -85.44 -1.75 57.38 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.413 0.625 . . . . 0.0 110.815 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.593 ' C ' ' HG2' ' A' ' 106' ' ' LYS . 4.1 m-20 -120.88 9.88 10.75 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.191 -173.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.672 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 31.7 m-85 -115.17 166.0 12.31 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.96 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.817 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -142.85 171.41 9.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.578 171.432 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.777 HD21 ' HB3' ' A' ' 101' ' ' PHE . 9.7 tp -124.0 145.48 49.17 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.7 mm? -98.78 130.34 45.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.631 179.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.604 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.7 pt-20 -95.55 84.92 4.05 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.404 1.097 . . . . 0.0 108.613 170.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.657 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 15.2 tt0 -85.62 124.23 31.93 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 121.465 -0.772 . . . . 0.0 108.961 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.522 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -114.46 110.09 30.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.14 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.514 HG23 ' HA2' ' A' ' 99' ' ' GLY . 61.3 t -81.57 113.75 21.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.721 -176.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -98.82 59.6 1.22 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.692 0.758 . . . . 0.0 109.353 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.47 133.9 47.26 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.722 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 7.6 t -143.9 128.85 18.49 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.988 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.7 p -129.08 8.77 5.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.501 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -74.44 -51.62 14.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.441 -176.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -73.03 -79.86 0.07 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.608 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.1 pttp 178.16 106.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.473 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.1 m -138.44 126.64 22.87 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.242 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 m -63.93 -52.04 61.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.938 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.446 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 33.2 p -135.37 138.01 27.75 Favored Pre-proline 0 C--O 1.235 0.339 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.883 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 36.6 Cg_exo -61.13 157.66 38.46 Favored 'Trans proline' 0 CA--C 1.519 -0.25 0 C-N-CA 123.177 2.584 . . . . 0.0 112.477 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -113.09 112.0 23.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.482 -174.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.455 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.6 m -96.94 103.7 15.65 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.542 176.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 m -82.23 99.53 9.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.562 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 25.8 tt0 -95.44 131.98 41.01 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 -174.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.478 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 21.7 tpp85 -129.1 159.98 34.28 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.806 HG11 HG11 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -118.21 145.77 23.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 118.442 0.565 . . . . 0.0 111.149 -175.669 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.453 HD12 ' HB3' ' A' ' 59' ' ' LEU . 42.4 mt -101.62 177.22 4.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.918 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' ASP . 30.4 tp -113.98 -49.39 2.86 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.929 0.492 . . . . 0.0 110.408 -175.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LEU . 3.5 p-10 178.46 -45.79 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.664 172.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.509 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 16.1 pt20 -117.35 34.65 5.02 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.0 mp0 -65.73 -14.78 61.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.863 -0.153 . . . . 0.0 111.213 173.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 68.2 m 66.88 104.87 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.558 0 O-C-N 123.795 0.684 . . . . 0.0 110.131 -174.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.551 ' H ' ' HA ' ' A' ' 30' ' ' THR . 15.2 m -74.79 -30.76 24.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -173.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -72.63 -37.86 67.91 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.554 -0.858 . . . . 0.0 108.804 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.685 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 57.7 mm-40 -65.02 -43.54 92.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.913 173.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.48 88.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 0.0 110.223 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 88' ' ' VAL . 5.0 tt0 -57.94 -42.29 84.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.57 -177.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.5 p -72.84 -12.53 61.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.679 -177.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.685 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 70.0 mmtt -87.25 -16.32 35.56 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.196 0.522 . . . . 0.0 110.823 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.4 m0 -60.73 157.9 13.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.438 -176.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.438 ' H ' HG21 ' A' ' 63' ' ' VAL . 25.0 mtmm -129.85 28.3 5.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.725 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.486 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -178.22 159.02 24.23 Favored Glycine 0 N--CA 1.442 -0.941 0 CA-C-N 113.802 -1.544 . . . . 0.0 109.644 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.486 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -81.62 106.8 13.86 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 117.504 0.652 . . . . 0.0 110.684 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.657 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -110.47 -151.96 13.05 Favored Glycine 0 N--CA 1.434 -1.471 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.033 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.443 ' HG3' ' C ' ' A' ' 99' ' ' GLY . 8.2 mtmt -149.79 144.2 25.86 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.777 ' HB3' HD21 ' A' ' 59' ' ' LEU . 86.2 m-85 -82.11 152.55 26.5 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.315 169.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.81 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 76.2 mt -138.67 126.4 27.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.176 -0.327 . . . . 0.0 111.072 -174.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.647 HD12 HD13 ' A' ' 35' ' ' ILE . 4.7 tp -75.57 134.63 40.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.56 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 8.4 tppt? -150.52 176.32 11.07 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.672 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.3 tp -103.69 139.19 39.29 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.817 ' HB3' HG13 ' A' ' 58' ' ' VAL . 17.5 ptmt -83.85 -34.21 24.68 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.009 -174.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.504 ' HA ' ' OE1' ' A' ' 110' ' ' GLN . 12.8 pt-20 -70.99 -2.61 15.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.421 0.629 . . . . 0.0 109.919 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.58 ' HG3' ' HB3' ' A' ' 116' ' ' LYS . 8.6 tt0 -106.25 -18.68 13.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.442 176.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.806 HG11 HG11 ' A' ' 81' ' ' VAL . 16.8 t -104.24 -19.04 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.527 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.504 ' OE1' ' HA ' ' A' ' 107' ' ' GLU . 16.1 pt20 -67.11 76.45 0.13 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.257 0.551 . . . . 0.0 111.693 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 68.06 -8.89 0.52 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.031 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.501 ' H ' ' C ' ' A' ' 110' ' ' GLN . 56.5 m 62.12 79.17 0.26 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.429 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.0 mmm180 -84.17 117.61 23.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.072 173.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 67.86 -177.3 0.21 Allowed 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.955 0.784 . . . . 0.0 110.492 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -103.95 132.65 50.0 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.58 ' HB3' ' HG3' ' A' ' 108' ' ' GLN . 55.3 tttp . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.372 -177.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.2 p . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m -90.79 97.1 10.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 170.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -77.63 -21.15 52.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.223 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -94.37 175.44 6.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.221 175.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.694 ' HB2' ' HD3' ' A' ' 27' ' ' ARG . 13.4 pt-20 -102.72 110.42 22.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.847 0.832 . . . . 0.0 109.925 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.467 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 49.8 p -123.39 145.06 49.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.077 -175.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.809 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.8 p90 -135.15 147.02 49.33 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -85.68 137.06 33.09 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.113 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.522 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.2 t -123.43 142.65 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.078 0.466 . . . . 0.0 110.477 176.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.482 ' HB3' HD11 ' A' ' 20' ' ' LEU . 38.9 mt-30 -110.62 107.38 16.95 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 166.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -123.18 139.11 50.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -177.652 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.487 ' HB2' HG12 ' A' ' 102' ' ' ILE . 10.5 m-70 -87.82 112.21 22.22 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.736 179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -91.51 171.49 9.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 171.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.9 t -79.58 -18.34 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.773 0.321 . . . . 0.0 110.735 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.77 ' HA ' ' HB2' ' A' ' 46' ' ' TYR . 13.7 m -62.93 138.85 97.32 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-O 121.507 0.67 . . . . 0.0 111.124 179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 15' ' ' SER . 93.4 Cg_endo -87.41 -7.21 6.84 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.546 2.83 . . . . 0.0 112.656 -175.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -73.43 -22.41 60.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.682 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.52 ' HG3' ' HA ' ' A' ' 21' ' ' THR . 6.7 tp-100 -154.23 89.54 3.32 Favored Pre-proline 0 C--N 1.32 -0.674 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HD2' ' HA ' ' A' ' 18' ' ' GLN . 7.0 Cg_endo -48.82 -63.58 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.322 2.681 . . . . 0.0 111.539 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 10' ' ' GLN . 65.4 tp -90.15 93.36 9.34 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.52 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.3 m -70.33 109.2 4.58 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.666 -177.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.0 121.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 pt -129.71 164.3 32.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.745 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 28.7 tttp -118.14 105.27 11.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB1' ' HD2' ' A' ' 26' ' ' PRO . . . -112.03 169.24 6.55 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.22 -174.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.724 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.3 Cg_endo -75.43 141.02 24.97 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 122.147 1.898 . . . . 0.0 111.993 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.809 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.7 mtp-105 -61.8 -6.17 2.5 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 122.147 0.975 . . . . 0.0 110.166 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.437 ' CG1' ' HB2' ' A' ' 26' ' ' PRO . 3.0 p -103.97 -20.52 5.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.194 -178.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.724 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 95.1 p -58.04 126.59 28.13 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 120.851 0.357 . . . . 0.0 110.08 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.443 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 28.4 p -94.78 -164.78 1.21 Allowed 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.529 ' HB2' HD13 ' A' ' 82' ' ' LEU . . . -61.94 -50.18 73.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.83 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -59.59 -33.95 72.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.102 0.477 . . . . 0.0 110.48 -179.196 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -69.26 -53.26 20.75 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 122.163 0.982 . . . . 0.0 109.599 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.461 ' CG1' HD22 ' A' ' 59' ' ' LEU . 5.6 p -68.84 -28.24 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 CA-C-N 113.352 -1.749 . . . . 0.0 110.357 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.705 HD13 ' HG ' ' A' ' 103' ' ' LEU . 3.8 mm -57.16 -57.77 8.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.366 171.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.571 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 33.2 tt0 -68.06 -33.61 74.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.003 -175.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -59.29 -42.64 91.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.2 m -70.14 -37.04 75.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.917 176.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 3.5 mp -52.59 -47.45 66.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.327 0.584 . . . . 0.0 110.59 172.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.549 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 16.1 t -69.97 -29.28 66.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.212 -176.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -81.88 -30.19 32.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 44' ' ' TYR . . . -103.65 18.02 22.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.808 -176.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 40' ' ' CYS . 18.5 pttp -71.05 30.84 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.651 ' HA ' HD11 ' A' ' 49' ' ' LEU . 15.3 p90 179.12 -20.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.036 0.534 . . . . 0.0 109.972 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.6 t -60.82 -69.51 0.23 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.911 -176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.77 ' HB2' ' HA ' ' A' ' 15' ' ' SER . 74.1 t80 -85.1 9.26 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 167.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 44' ' ' TYR . 13.1 m 62.54 54.39 2.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 113.852 -1.522 . . . . 0.0 110.395 -173.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.0 mm -81.1 62.76 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 122.03 0.919 . . . . 0.0 109.207 174.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.651 HD11 ' HA ' ' A' ' 44' ' ' TYR . 5.1 mp -105.66 -24.03 12.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.287 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.6 m -64.34 -36.65 84.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.774 -176.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -123.27 97.89 42.28 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -87.5 -14.09 3.93 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.488 2.125 . . . . 0.0 113.617 -176.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.495 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -96.46 132.16 27.01 Favored Pre-proline 0 N--CA 1.454 -0.241 0 CA-C-O 121.745 0.783 . . . . 0.0 110.986 -176.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.495 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 86.9 Cg_endo -91.72 3.57 4.09 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.833 2.355 . . . . 0.0 112.745 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.634 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 19.2 m -75.73 -10.09 59.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.217 -177.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 11.7 m-20 -99.19 -1.52 39.06 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.972 0.415 . . . . 0.0 110.265 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.56 ' HB3' HD12 ' A' ' 35' ' ' ILE . 50.6 m-85 -101.54 145.1 29.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.653 -174.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -131.63 144.16 38.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.888 165.649 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.808 HD21 ' HB3' ' A' ' 101' ' ' PHE . 18.4 tp -97.03 142.56 28.82 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.407 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.541 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.4 mm? -98.44 129.62 45.06 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 176.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.657 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 12.4 pt-20 -93.25 87.76 5.78 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 170.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.5 tt0 -85.61 125.04 32.82 Favored 'General case' 0 N--CA 1.425 -1.694 0 O-C-N 121.045 -1.034 . . . . 0.0 109.783 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.652 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.82 112.65 39.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.322 0.582 . . . . 0.0 110.468 175.893 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.505 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.7 t -76.44 105.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.437 176.424 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -115.82 87.33 2.65 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 122.038 0.923 . . . . 0.0 108.994 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -94.93 174.4 7.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.93 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.8 t -110.83 104.19 12.79 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 121.749 0.785 . . . . 0.0 108.988 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.9 m -83.09 -28.95 29.13 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.257 -177.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -69.28 -57.34 5.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.989 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -96.27 132.44 41.74 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.905 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.41 ' HD2' ' HA ' ' A' ' 71' ' ' LYS . 5.9 mmmp? -120.9 33.5 5.54 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.8 t -78.79 -22.72 45.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.148 0.499 . . . . 0.0 109.829 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 t -123.8 -179.02 4.22 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.684 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 39.1 p -105.16 156.88 35.46 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.609 0.242 . . . . 0.0 111.045 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -55.76 132.54 52.68 Favored 'Trans proline' 0 CA--C 1.516 -0.395 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -125.18 134.44 52.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.75 0.786 . . . . 0.0 112.128 -172.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 54.4 p -92.61 118.55 31.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.7 m -94.04 101.76 13.81 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.633 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.27 131.47 39.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.72 -175.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.506 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 33.8 ttt180 -124.63 153.85 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.861 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -109.26 130.17 62.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.552 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 31' ' ' ALA . 21.2 mt -85.83 165.65 16.67 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.515 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.509 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 75.0 mt -84.39 178.93 7.56 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 166.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 33.5 m-20 -55.22 -48.33 74.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.191 0.519 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -121.69 50.78 1.38 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.121 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.509 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -71.82 -3.96 25.19 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 174.859 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 32.6 m 66.11 104.69 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.188 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.447 HG13 ' CA ' ' A' ' 31' ' ' ALA . 23.6 m -74.45 -26.25 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.508 0 O-C-N 122.228 -0.295 . . . . 0.0 111.641 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -71.97 -35.18 69.44 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.501 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -66.32 -48.15 71.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.199 175.123 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.411 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -54.4 -48.83 71.14 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.969 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -56.94 -47.94 79.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.46 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.6 p -70.61 -6.67 38.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.448 0.642 . . . . 0.0 110.839 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 25.9 ttpp -106.66 0.25 24.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.106 -176.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.464 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -74.22 157.39 35.97 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.754 0.787 . . . . 0.0 112.906 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.652 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.6 mppt? -120.65 23.78 10.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.22 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 176.28 -175.06 47.36 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.344 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.46 104.99 16.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 117.386 0.593 . . . . 0.0 111.092 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.625 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -111.56 -145.98 10.22 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.42 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.37 145.46 13.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.225 0.61 . . . . 0.0 109.636 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.808 ' HB3' HD21 ' A' ' 59' ' ' LEU . 93.4 m-85 -79.96 140.8 36.49 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.991 175.248 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.487 HG12 ' HB2' ' A' ' 12' ' ' HIS . 70.0 mt -129.03 125.69 63.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 122.187 -0.321 . . . . 0.0 111.246 -173.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.705 ' HG ' HD13 ' A' ' 35' ' ' ILE . 6.4 mp -73.86 128.35 35.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.023 0.439 . . . . 0.0 111.219 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.508 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 21.1 ttmm -145.72 177.87 8.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 57' ' ' TYR . 18.1 mt -108.87 143.41 38.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.374 0.607 . . . . 0.0 112.041 179.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.634 ' HD3' ' O ' ' A' ' 55' ' ' SER . 18.9 ptmt -83.56 -16.55 44.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.326 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -73.27 -13.31 61.11 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.741 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -105.55 -43.53 4.92 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.861 HG11 HG11 ' A' ' 81' ' ' VAL . 80.1 t -78.33 77.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.206 170.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.423 ' C ' ' H ' ' A' ' 112' ' ' SER . 9.4 pt20 -111.47 32.8 5.11 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.116 -171.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 72.7 -19.23 0.31 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.497 0.719 . . . . 0.0 112.55 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.423 ' H ' ' C ' ' A' ' 110' ' ' GLN . 85.1 p 61.13 136.64 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.968 1.307 . . . . 0.0 112.865 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -25.18 59.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.652 -179.136 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -91.86 20.26 5.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.46 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -64.63 111.19 2.62 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.665 ' HE2' ' HA ' ' A' ' 116' ' ' LYS . 10.6 mmpt? . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.355 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 p -93.66 126.44 38.83 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.154 -0.314 . . . . 0.0 110.154 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -83.33 -23.03 32.72 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.945 0.403 . . . . 0.0 109.93 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -68.94 141.91 54.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.283 176.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.526 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 35.6 tt0 -102.16 124.34 47.58 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.597 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.4 140.49 31.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.078 0.466 . . . . 0.0 110.415 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.624 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 3.4 p90 -106.13 155.78 19.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -176.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -90.88 137.01 32.69 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.255 -174.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.603 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.2 t -122.49 141.0 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.625 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.579 ' HB3' HD11 ' A' ' 20' ' ' LEU . 41.8 mt-30 -111.43 109.24 19.11 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 165.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.73 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.4 p -135.83 137.9 48.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.776 0.322 . . . . 0.0 111.131 -173.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 -97.92 170.04 9.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 111.195 -177.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -143.93 -176.82 5.14 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 170.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.02 -22.66 6.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.412 0.625 . . . . 0.0 109.317 175.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.0 t -64.59 132.98 95.56 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.778 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.77 ' HD2' ' HB2' ' A' ' 46' ' ' TYR . 77.7 Cg_endo -78.11 -173.95 2.04 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 123.227 2.618 . . . . 0.0 112.524 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 67.81 96.64 0.06 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.786 -175.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.58 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 10.6 mm-40 67.69 81.99 0.2 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.53 -172.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.18 -45.4 27.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.146 2.564 . . . . 0.0 112.671 -177.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.579 HD11 ' HB3' ' A' ' 10' ' ' GLN . 60.1 tp -90.17 105.94 18.15 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.59 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 25.7 m -80.14 108.92 14.12 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.197 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.44 114.92 33.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.471 0.653 . . . . 0.0 109.512 177.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.603 HG13 ' HB ' ' A' ' 9' ' ' VAL . 14.1 pt -124.77 174.15 9.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.985 -176.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -124.42 96.88 5.07 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 171.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.87 163.65 17.37 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.7 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.936 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.2 Cg_endo -70.08 144.16 51.47 Favored 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 121.925 1.75 . . . . 0.0 111.99 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.624 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 52.1 mtp180 -61.02 -8.82 3.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.394 0.616 . . . . 0.0 110.729 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -106.99 -5.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.99 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.936 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -56.2 126.64 27.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.55 0.69 . . . . 0.0 110.961 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.532 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.5 t -107.1 -179.15 3.85 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.057 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.69 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.56 -48.82 27.69 Favored 'General case' 0 C--O 1.211 -0.934 0 O-C-N 123.484 0.49 . . . . 0.0 111.822 -172.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.752 ' HA ' HD12 ' A' ' 35' ' ' ILE . 5.5 pp0? -71.46 -27.18 63.08 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.864 -177.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.83 -52.41 30.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 122.004 0.907 . . . . 0.0 108.978 176.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.45 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.38 -26.89 37.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.125 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 57' ' ' TYR . 8.4 mt -55.7 -57.55 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.261 169.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.0 tt0 -65.45 -32.65 74.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.831 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.467 ' HG2' HD12 ' A' ' 23' ' ' ILE . 45.5 tp60 -61.73 -45.15 95.19 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.165 0.507 . . . . 0.0 110.137 175.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.526 ' HB ' HD22 ' A' ' 103' ' ' LEU . 20.5 m -69.05 -38.39 79.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.89 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -50.65 -42.25 56.28 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.214 0.531 . . . . 0.0 110.67 171.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.36 -46.56 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.505 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -79.92 -19.91 46.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -90.66 13.21 16.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.878 0.371 . . . . 0.0 110.573 177.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.671 ' HA ' HD21 ' A' ' 49' ' ' LEU . 36.6 ttmt -58.12 102.78 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.259 -176.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.517 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 98.3 m-85 58.27 27.36 15.11 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.06 179.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.2 m -73.23 -85.3 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.77 ' HB2' ' HD2' ' A' ' 16' ' ' PRO . 57.9 t80 -95.64 12.85 28.28 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.9 t 63.92 83.95 0.16 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.581 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.49 HG22 ' O ' ' A' ' 48' ' ' ILE . 41.7 mm -103.28 18.67 4.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 123.043 1.402 . . . . 0.0 107.728 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.671 HD21 ' HA ' ' A' ' 43' ' ' LYS . 2.1 mm? -102.26 10.02 39.55 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.129 -166.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -67.59 -33.38 74.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 174.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -122.72 90.19 49.94 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.609 169.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.57 13.94 2.53 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.491 2.127 . . . . 0.0 111.641 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.478 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.9 p-10 -107.81 136.44 19.7 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.101 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.49 ' HA ' HG21 ' A' ' 35' ' ' ILE . 6.3 Cg_exo -78.68 16.66 1.25 Allowed 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.928 2.419 . . . . 0.0 111.873 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.2 m -87.15 -36.36 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.486 -173.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.531 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 32.3 m-20 -102.2 18.17 21.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.241 0.543 . . . . 0.0 111.298 -173.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.78 ' HB2' HD13 ' A' ' 35' ' ' ILE . 11.8 m-85 -116.5 177.85 4.55 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.616 0.722 . . . . 0.0 110.63 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.42 HG22 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -148.26 -179.73 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.844 170.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.989 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -144.27 139.96 28.92 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.591 ' CD1' HG13 ' A' ' 81' ' ' VAL . 2.3 mm? -104.0 127.86 51.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.896 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.3 pt-20 -94.3 86.35 4.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.432 1.111 . . . . 0.0 108.39 167.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.557 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -86.71 123.66 32.12 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.078 175.232 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.567 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -115.64 118.33 58.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.224 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 84.4 t -68.94 109.33 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.231 0.539 . . . . 0.0 110.815 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.431 ' HG2' HG22 ' A' ' 63' ' ' VAL . 25.3 mmmt -115.94 90.81 3.42 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.018 175.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.47 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 4.9 p-10 -58.46 169.65 0.87 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.984 -170.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.437 HG21 ' HB ' ' A' ' 72' ' ' THR . 2.1 t -107.24 91.5 3.68 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.378 174.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.1 m -64.96 -24.66 67.58 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 0.0 109.513 176.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -87.56 -154.47 0.26 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.945 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -124.15 96.85 5.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 120.369 -0.533 . . . . 0.0 112.058 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.1 mtpp -131.85 -3.58 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.001 170.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.609 HG22 ' H ' ' A' ' 74' ' ' THR . 37.1 m -157.74 148.71 21.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 9.9 t -72.24 -17.69 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.615 0.245 . . . . 0.0 111.538 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.609 ' H ' HG22 ' A' ' 72' ' ' THR . 16.2 p -137.51 160.19 66.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.324 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -51.02 127.83 22.96 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.239 1.96 . . . . 0.0 111.213 171.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.47 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 20.6 pttp -100.16 147.66 25.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.828 -167.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.1 m -99.27 137.51 37.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.442 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.4 t -102.54 99.25 9.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.534 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 43.8 tt0 -94.97 132.05 40.24 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.028 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -129.22 144.09 51.09 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.756 HG11 HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -103.78 141.1 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 118.71 0.686 . . . . 0.0 110.928 -178.024 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.656 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 7.8 mt -101.27 156.81 17.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.521 -176.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.6 mp -86.1 171.83 11.05 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 165.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.47 -31.38 55.62 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -176.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 6.9 pt20 -121.47 33.13 5.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -176.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.656 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 11.7 mm-40 -72.58 -11.74 60.77 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.559 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 55.5 m 68.08 118.61 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.403 0.621 . . . . 0.0 111.931 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.532 ' H ' ' HA ' ' A' ' 30' ' ' THR . 91.7 t -75.78 -37.08 34.76 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.864 -175.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -72.74 -38.78 67.28 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.559 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 18.1 mt-30 -58.36 -45.71 87.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.309 172.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.516 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.35 -50.99 70.7 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.117 178.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.446 ' OE1' ' HE2' ' A' ' 101' ' ' PHE . 12.1 tt0 -59.35 -24.97 63.81 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.674 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -82.93 -9.21 59.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.129 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 80.3 mttt -86.53 -24.18 25.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.201 0.524 . . . . 0.0 110.538 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.404 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 44.5 m0 -56.16 143.49 33.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.984 -1.007 . . . . 0.0 113.168 -168.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -124.87 20.21 8.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.255 -1.338 . . . . 0.0 108.891 177.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.509 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -168.17 155.22 25.78 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 108.526 -1.83 . . . . 0.0 108.526 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.04 103.92 11.18 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 118.08 0.94 . . . . 0.0 111.256 -176.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.567 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -109.64 -147.66 11.97 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.725 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.01 155.05 32.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.989 ' HB3' HD11 ' A' ' 59' ' ' LEU . 94.8 m-85 -85.35 151.4 24.05 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 168.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.582 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.5 mp -131.01 125.87 58.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 O-C-N 121.829 -0.544 . . . . 0.0 110.054 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.526 HD22 ' HB ' ' A' ' 38' ' ' THR . 25.0 tp -80.61 133.63 35.78 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -146.93 159.68 43.26 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 0.8 OUTLIER -82.89 150.77 26.3 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.634 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.2 ptmm? -78.11 -24.09 47.64 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.453 0.644 . . . . 0.0 109.307 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -77.09 3.79 11.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.942 169.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -122.8 1.07 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.756 HG21 HG11 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -116.82 -4.11 11.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.966 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -61.59 82.61 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.847 0.832 . . . . 0.0 113.014 -167.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.05 3.52 38.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.245 170.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.5 t -80.78 164.4 22.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.847 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.9 mmt85 -67.54 -37.76 83.2 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -140.98 142.89 34.24 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.437 176.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.05 -28.02 12.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.258 0.551 . . . . 0.0 110.395 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.9 mttp . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.797 -177.84 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.1 p . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 121.065 0.46 . . . . 0.0 110.696 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.401 ' HB3' ' HG2' ' A' ' 4' ' ' GLU . 23.1 t -143.34 -167.84 2.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.122 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -100.11 -4.14 30.37 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.982 0.42 . . . . 0.0 110.024 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.401 ' HG2' ' HB3' ' A' ' 2' ' ' SER . 9.9 pt-20 -83.06 10.18 8.64 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.53 0.681 . . . . 0.0 110.554 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 5' ' ' GLU . 7.6 pt-20 -113.43 122.77 48.33 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.81 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p -154.9 140.31 17.75 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.607 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.2 p90 -132.21 152.18 51.44 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -85.86 129.76 34.74 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.023 0.439 . . . . 0.0 111.396 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.596 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.0 t -118.1 118.03 56.8 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.323 178.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.627 ' HB3' HD11 ' A' ' 20' ' ' LEU . 80.6 mt-30 -90.56 108.04 19.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 164.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.805 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -121.66 114.33 42.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 121.653 0.74 . . . . 0.0 111.135 -178.888 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.588 ' HB2' HG13 ' A' ' 102' ' ' ILE . 16.4 m80 -71.43 141.03 50.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.905 -178.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -109.41 162.02 14.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 171.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.63 -21.35 7.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.449 0.643 . . . . 0.0 110.018 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.619 ' HB2' ' HB3' ' A' ' 46' ' ' TYR . 1.2 m -83.52 146.99 51.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.965 -175.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -82.89 134.78 7.34 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.418 2.078 . . . . 0.0 112.734 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 168.16 -56.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.458 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.7 tp60 -154.64 96.64 2.58 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 113.451 -1.704 . . . . 0.0 106.934 169.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -47.77 -37.89 28.89 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.383 2.722 . . . . 0.0 112.978 -169.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.627 HD11 ' HB3' ' A' ' 10' ' ' GLN . 41.0 tp -107.47 109.68 21.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.081 177.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 21.6 m -85.58 108.45 17.97 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.425 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.4 t -94.22 111.78 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 O-C-N 122.055 -0.403 . . . . 0.0 110.306 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 9' ' ' VAL . 22.5 pt -123.15 170.3 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.161 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 tttt -119.16 113.73 21.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.408 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -115.43 168.49 8.22 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.742 -176.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.891 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.6 Cg_endo -75.38 143.46 27.91 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.01 1.807 . . . . 0.0 111.568 -179.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.607 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 67.2 mtt180 -59.31 -18.37 37.27 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.506 0.67 . . . . 0.0 110.495 -176.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.38 -14.34 9.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.137 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.891 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.1 p -55.42 128.52 34.68 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.753 0.787 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.526 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -111.23 177.55 4.62 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.364 176.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.74 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -49.78 -52.77 29.51 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 123.642 0.589 . . . . 0.0 111.306 -171.007 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.512 ' OE1' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -57.17 -34.92 68.95 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.721 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.47 -52.4 10.78 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.467 0.651 . . . . 0.0 110.523 -175.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.738 HG11 HD22 ' A' ' 59' ' ' LEU . 3.3 p -62.54 -27.62 43.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.064 177.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.74 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.6 mm -56.01 -57.29 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.976 172.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.436 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 63.4 tt0 -71.82 -32.55 67.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -177.134 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -56.94 -37.77 71.99 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.04 0.448 . . . . 0.0 110.077 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.0 m -70.52 -38.5 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.965 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 9.2 mp -54.59 -43.62 72.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.851 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 51.2 t -71.07 -37.57 72.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.762 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -73.46 -25.43 60.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.885 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.692 ' HB1' ' HB2' ' A' ' 46' ' ' TYR . . . -108.52 17.21 22.29 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -172.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.501 ' C ' ' H ' ' A' ' 45' ' ' SER . 17.1 pttm -65.04 107.58 1.56 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.128 0.49 . . . . 0.0 110.978 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.844 ' HA ' HD21 ' A' ' 49' ' ' LEU . 85.4 m-85 71.07 -28.9 0.18 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.106 -177.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.521 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 25.3 m -53.71 -69.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.55 0.74 . . . . 0.0 110.9 176.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.692 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 26.9 m-85 -88.44 11.81 15.97 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 173.242 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.446 ' C ' HD22 ' A' ' 49' ' ' LEU . 1.1 m 54.8 39.86 31.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.355 -1.293 . . . . 0.0 110.906 -174.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.481 ' O ' HD13 ' A' ' 49' ' ' LEU . 38.5 mm -85.81 78.51 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.475 174.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.844 HD21 ' HA ' ' A' ' 44' ' ' TYR . 2.0 mm? -124.68 -23.61 4.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.6 m -57.91 -49.36 77.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.759 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -110.02 93.05 14.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 174.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -84.76 -3.08 9.84 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.89 2.393 . . . . 0.0 111.941 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -103.43 133.79 20.11 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.863 177.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.512 ' HB2' ' OE1' ' A' ' 32' ' ' GLN . 89.8 Cg_endo -85.59 5.35 6.15 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.658 2.239 . . . . 0.0 113.074 -175.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.46 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 15.5 p -85.26 -6.11 59.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.204 -175.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.526 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.2 m-20 -103.59 4.54 35.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.883 0.373 . . . . 0.0 110.552 175.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.602 ' HB3' HD12 ' A' ' 35' ' ' ILE . 61.1 m-85 -110.4 155.94 21.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 110.832 -177.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.02 146.75 21.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 170.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.781 HD21 ' HB3' ' A' ' 101' ' ' PHE . 16.1 tp -99.68 147.8 25.03 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.046 0.451 . . . . 0.0 110.803 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.621 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.4 mm? -106.1 133.34 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.594 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.676 ' HB3' HD21 ' A' ' 82' ' ' LEU . 11.8 pt-20 -94.59 85.23 4.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.706 1.241 . . . . 0.0 108.484 170.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.615 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 14.6 tt0 -86.12 122.86 30.74 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.387 -0.82 . . . . 0.0 109.262 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.538 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.9 OUTLIER -113.36 111.98 38.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-O 121.234 0.54 . . . . 0.0 110.173 176.552 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.641 HG23 ' HA2' ' A' ' 99' ' ' GLY . 79.7 t -70.56 99.78 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.177 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.629 ' HD3' ' HB2' ' A' ' 96' ' ' LYS . 24.6 mmmt -94.49 87.63 5.2 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.179 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.428 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 9.5 p-10 -80.57 123.91 28.52 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.422 ' O ' ' HB ' ' A' ' 73' ' ' THR . 5.5 t -149.01 106.76 3.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.661 0.743 . . . . 0.0 111.418 -174.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.555 HG23 ' H ' ' A' ' 73' ' ' THR . 62.4 m -101.31 -57.88 2.0 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.122 171.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 62.66 -82.19 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.256 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -109.82 -78.99 0.58 Allowed 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.058 -170.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -82.41 150.65 26.98 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.8 m -54.34 101.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.274 0.559 . . . . 0.0 110.757 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.555 ' H ' HG23 ' A' ' 68' ' ' THR . 17.7 m -121.9 128.9 52.09 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.376 -177.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.44 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 32.7 p -71.26 142.91 87.56 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.795 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 31.6 Cg_exo -60.14 148.13 90.7 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 123.003 2.469 . . . . 0.0 111.248 174.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.5 157.42 45.68 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.523 -171.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 57.0 m -118.1 103.77 10.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.616 174.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.531 ' HB3' HG13 ' A' ' 63' ' ' VAL . 20.7 t -80.29 99.35 7.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.25 131.26 40.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.536 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 35.6 ttt-85 -128.35 152.73 47.82 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.869 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.92 144.23 16.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.988 0.813 . . . . 0.0 110.719 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.676 HD21 ' HB3' ' A' ' 61' ' ' GLU . 16.9 mt -100.17 158.8 15.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.284 -176.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.8 mp -92.46 -179.19 5.13 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.0 -52.3 34.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.302 0.377 . . . . 0.0 111.337 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -119.52 51.59 1.15 Allowed 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.6 tp10 -73.12 -21.17 60.78 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.101 0.477 . . . . 0.0 109.738 170.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 54.9 m 73.7 124.98 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.267 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.524 ' H ' ' HA ' ' A' ' 30' ' ' THR . 89.4 t -75.05 -42.94 45.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.521 -173.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 92.9 t80 -73.02 -33.38 65.71 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.59 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 41.5 mt-30 -64.12 -41.25 97.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.568 172.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.182 0.515 . . . . 0.0 110.386 176.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -63.39 -28.66 70.14 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.643 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.8 p -78.65 -6.8 56.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.874 0.369 . . . . 0.0 110.934 178.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 34.3 mmtp -88.19 -22.04 24.24 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.302 0.573 . . . . 0.0 109.829 176.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.449 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.5 m0 -62.3 148.29 45.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.866 -173.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.629 ' HB2' ' HD3' ' A' ' 65' ' ' LYS . 95.1 mttt -117.59 13.1 14.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.122 178.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -167.58 173.8 42.64 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.08 100.46 13.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 117.777 0.789 . . . . 0.0 111.208 -176.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.641 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -104.3 -145.11 13.91 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.997 -178.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.589 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -153.2 153.16 32.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 174.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.805 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.3 m-85 -87.95 122.59 31.75 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 170.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.621 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -101.19 123.61 54.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 O-C-N 121.81 -0.556 . . . . 0.0 110.444 -171.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.62 HD12 HD13 ' A' ' 35' ' ' ILE . 6.0 tp -74.99 127.19 32.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.558 ' HD2' HG23 ' A' ' 109' ' ' VAL . 15.5 ttmm -147.03 170.25 17.53 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.1 mp -95.98 160.11 14.63 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 175.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 10.9 ptmm? -89.06 -5.6 57.74 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 122.11 0.957 . . . . 0.0 109.6 175.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.68 -17.87 34.77 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.361 166.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.472 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 96.5 mt-30 -95.87 -40.14 9.46 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.869 HG11 HG11 ' A' ' 81' ' ' VAL . 76.1 t -88.76 72.38 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 113.988 -1.46 . . . . 0.0 108.85 167.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' A' ' 112' ' ' SER . 1.3 mm-40 -110.63 -161.28 0.75 Allowed 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.95 41.93 0.61 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 110' ' ' GLN . 15.8 m -44.98 109.67 0.18 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 113.879 -1.509 . . . . 0.0 113.426 -167.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.443 ' HA ' ' NE ' ' A' ' 113' ' ' ARG . 4.4 mmp_? -86.18 99.83 11.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 170.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 75.23 -52.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.445 0 O-C-N 124.018 0.824 . . . . 0.0 111.065 -174.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -158.45 149.12 20.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.483 0.182 . . . . 0.0 110.896 177.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 123.646 0.778 . . . . 0.0 112.286 178.983 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.3 m . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 120.899 0.381 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -110.14 178.33 4.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.287 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -90.25 -15.62 30.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.408 0.623 . . . . 0.0 109.862 177.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -88.01 10.57 18.58 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.48 -173.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 5' ' ' GLU . 5.7 pt-20 -124.29 111.25 15.6 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.724 0.773 . . . . 0.0 111.873 -173.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.9 p -150.37 139.48 21.12 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.316 -0.857 . . . . 0.0 109.1 170.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.713 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.3 p90 -137.74 155.04 49.5 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -177.246 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -90.21 133.74 34.73 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.063 0.459 . . . . 0.0 111.586 -174.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.587 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -119.52 121.23 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.274 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.569 ' HB3' HD11 ' A' ' 20' ' ' LEU . 95.9 mt-30 -95.56 108.45 20.7 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 166.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.77 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -125.43 123.44 64.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.393 0.616 . . . . 0.0 111.092 -175.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.56 ' HB2' HG13 ' A' ' 102' ' ' ILE . 63.2 m-70 -79.19 150.41 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.695 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -120.52 172.82 7.56 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 169.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.18 -21.7 9.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.083 0.468 . . . . 0.0 110.523 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.603 ' HB2' ' HD2' ' A' ' 46' ' ' TYR . 4.6 m -77.36 160.68 74.85 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.285 -176.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.472 ' HB2' ' H ' ' A' ' 17' ' ' GLU . 85.3 Cg_endo -79.18 -141.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.781 2.321 . . . . 0.0 112.612 177.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.472 ' H ' ' HB2' ' A' ' 16' ' ' PRO . 10.3 tp10 72.39 -66.81 0.29 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.464 0.706 . . . . 0.0 110.33 -175.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.488 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.3 tp60 -148.07 94.83 4.23 Favored Pre-proline 0 C--N 1.317 -0.837 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.87 -41.92 25.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.564 2.843 . . . . 0.0 113.165 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 10' ' ' GLN . 58.3 tp -101.13 107.89 19.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.838 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.6 m -77.5 144.97 37.3 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 174.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.0 t -125.99 118.08 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.587 HG13 ' HB ' ' A' ' 9' ' ' VAL . 7.3 pt -127.41 169.48 18.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 tttt -120.59 104.16 9.72 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 171.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.576 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -102.35 170.02 6.87 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.792 -175.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.881 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 3.8 Cg_endo -75.75 142.65 25.89 Favored 'Trans proline' 0 N--CA 1.446 -1.321 0 C-N-CA 122.007 1.804 . . . . 0.0 111.302 178.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.713 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 77.9 mtt180 -59.89 -15.62 22.79 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.219 0.533 . . . . 0.0 110.82 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.91 -12.58 8.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.841 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.881 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.9 p -54.69 127.19 27.08 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.63 0.729 . . . . 0.0 110.829 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.578 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -107.95 -179.08 3.79 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.515 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.83 -51.52 29.07 Favored 'General case' 0 C--O 1.212 -0.897 0 O-C-N 123.579 0.549 . . . . 0.0 110.862 -172.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -37.8 69.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -70.7 -53.37 15.89 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 122.234 1.016 . . . . 0.0 109.966 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.651 HG11 HD22 ' A' ' 59' ' ' LEU . 3.0 p -66.05 -27.23 40.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 113.525 -1.67 . . . . 0.0 110.175 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.56 HD13 HD12 ' A' ' 103' ' ' LEU . 3.7 mm -56.12 -57.32 8.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.797 172.058 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.55 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 40.0 tp60 -69.25 -33.6 73.5 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.576 HE22 ' HA ' ' A' ' 25' ' ' ALA . 32.6 tt0 -60.41 -42.3 95.72 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.859 0.361 . . . . 0.0 110.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.1 m -67.34 -37.07 82.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.046 174.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -55.18 -41.9 72.5 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.131 0.491 . . . . 0.0 110.611 172.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.509 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 52.5 t -72.65 -34.28 67.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.886 -178.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -74.3 -39.29 63.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.013 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.637 ' HB1' ' HB2' ' A' ' 46' ' ' TYR . . . -96.1 0.25 51.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -172.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 40' ' ' CYS . 20.2 pttm -61.95 118.1 6.82 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.095 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.832 ' HA ' HD21 ' A' ' 49' ' ' LEU . 83.5 m-85 71.63 -41.64 0.51 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.933 0.893 . . . . 0.0 111.037 -176.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.502 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 29.5 m -50.4 -67.25 0.27 Allowed 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.782 0.833 . . . . 0.0 111.358 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.637 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 5.8 m-85 -92.39 19.85 6.75 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.448 ' C ' HD22 ' A' ' 49' ' ' LEU . 3.8 p 44.82 44.3 7.63 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.605 -170.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.506 ' O ' HD13 ' A' ' 49' ' ' LEU . 46.6 mm -86.49 75.16 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.482 174.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.832 HD21 ' HA ' ' A' ' 44' ' ' TYR . 1.7 mm? -122.51 -5.17 8.75 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.215 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 m -68.03 -50.56 54.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.214 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.418 ' HB3' ' HE1' ' A' ' 57' ' ' TYR . 6.6 m-20 -117.28 94.51 45.32 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.4 175.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -84.6 0.87 8.91 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.696 2.264 . . . . 0.0 111.292 175.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -103.27 124.56 37.85 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.938 177.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.54 -2.4 12.44 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.912 2.408 . . . . 0.0 113.091 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.8 p -69.88 -23.68 63.3 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.537 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 18.0 m-20 -97.23 9.41 42.29 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.622 0.248 . . . . 0.0 111.574 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 43.0 m-85 -111.55 153.64 25.95 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.918 0.39 . . . . 0.0 110.738 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.58 142.69 30.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.059 169.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.651 HD22 HG11 ' A' ' 34' ' ' VAL . 15.8 tp -93.66 145.33 24.63 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.07 0.462 . . . . 0.0 110.412 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.7 mm? -107.04 129.4 54.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.831 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.671 ' HB3' HD21 ' A' ' 82' ' ' LEU . 15.4 pt-20 -91.13 85.34 5.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.565 1.174 . . . . 0.0 108.283 169.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.639 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 14.3 tt0 -86.29 123.82 31.97 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.632 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.572 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -117.77 116.29 51.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.864 175.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.546 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 95.6 t -65.66 104.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.675 0.75 . . . . 0.0 110.385 178.06 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.552 ' HG2' HG22 ' A' ' 63' ' ' VAL . 19.8 mmmt -111.28 98.38 7.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.171 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.528 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 4.0 p-10 -60.19 144.13 50.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.776 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.3 t -119.51 18.54 12.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.121 0.486 . . . . 0.0 110.302 -176.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 33.0 m -55.65 -67.03 0.32 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.786 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.416 ' HB2' ' H ' ' A' ' 70' ' ' LYS . 45.0 m-20 57.33 -88.36 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.111 174.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' H ' ' HB2' ' A' ' 69' ' ' ASN . 14.5 mmmm -89.56 -40.72 12.44 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.505 -173.251 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.423 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 4.6 ttmp? -142.25 155.7 45.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.856 -173.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.9 m -48.1 107.42 0.12 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.279 0.562 . . . . 0.0 111.711 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.1 m -142.64 132.84 24.63 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.497 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 33.4 p -58.23 133.97 84.6 Favored Pre-proline 0 C--N 1.331 -0.232 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 25.3 Cg_exo -66.3 142.76 67.81 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.102 2.535 . . . . 0.0 112.284 178.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -112.33 165.73 11.93 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.98 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 2.0 p -116.41 103.79 10.8 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -75.82 99.03 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.221 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 40.2 tt0 -94.49 131.44 40.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -175.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.541 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 3.6 tmt_? -132.93 137.41 46.6 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 1.033 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -98.05 137.41 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.679 -173.911 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.71 HD22 ' HG2' ' A' ' 86' ' ' GLU . 11.7 mt -94.04 168.64 10.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.258 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 83' ' ' LEU . 6.4 mp -107.82 -174.38 2.51 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.519 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -47.13 -53.71 12.26 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.397 0.435 . . . . 0.0 111.583 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 5.7 pt20 -125.25 67.54 1.13 Allowed 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.71 ' HG2' HD22 ' A' ' 82' ' ' LEU . 16.6 tp10 -77.49 -23.97 50.21 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 165.048 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 72.0 m 75.12 121.44 0.04 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.233 -174.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.503 ' H ' ' HA ' ' A' ' 30' ' ' THR . 78.2 t -75.2 -40.15 43.49 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-O 121.203 0.525 . . . . 0.0 110.383 -172.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 87.9 t80 -73.41 -32.73 64.6 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.637 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 36.0 mt-30 -69.82 -33.49 72.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.969 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.39 -43.7 66.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.245 0.545 . . . . 0.0 110.067 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -62.24 -29.44 70.4 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.506 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.8 p -81.02 -4.91 56.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.852 0.358 . . . . 0.0 111.277 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 32.7 mmtp -85.15 -24.18 28.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.472 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.0 m0 -61.74 148.02 44.29 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.41 -169.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -127.47 19.74 6.78 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.238 -1.347 . . . . 0.0 108.818 176.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -161.07 169.93 36.78 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.59 98.8 11.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 118.047 0.923 . . . . 0.0 111.137 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.639 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -110.65 -152.1 12.89 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 119.965 -1.112 . . . . 0.0 112.109 -177.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.522 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.9 mptp? -153.81 155.03 35.06 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.77 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 94.3 m-85 -85.19 126.73 33.89 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.937 -0.705 . . . . 0.0 109.147 171.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -103.2 124.35 57.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 O-C-N 121.771 -0.581 . . . . 0.0 110.633 -175.02 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.56 HD12 HD13 ' A' ' 35' ' ' ILE . 8.4 tp -81.84 105.5 13.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.527 ' HD2' HG23 ' A' ' 109' ' ' VAL . 18.5 ttmm -126.09 171.37 10.89 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.5 mp -92.58 162.3 14.24 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 13.7 ptmm? -91.03 -7.99 50.34 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.925 0.869 . . . . 0.0 109.617 174.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -83.96 -15.23 48.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.205 168.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -102.82 -38.2 7.53 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 1.033 HG11 HG11 ' A' ' 81' ' ' VAL . 76.1 t -88.77 78.09 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.875 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.203 166.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 1.2 mm-40 -123.11 -168.83 1.83 Allowed 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.032 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.29 80.44 1.84 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 170.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.4 m -61.38 91.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.984 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.476 ' HD3' ' HA ' ' A' ' 113' ' ' ARG . 17.0 mmt180 -91.22 97.19 10.98 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 168.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 113' ' ' ARG . 39.6 mt-10 75.5 -42.85 0.48 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.324 1.015 . . . . 0.0 110.798 -174.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -169.43 167.32 10.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm . . . . . 0 N--CA 1.468 0.449 0 O-C-N 123.314 0.384 . . . . 0.0 111.438 178.311 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 120.937 0.399 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -142.91 -164.9 1.94 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.536 -177.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -113.54 7.65 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.242 0.544 . . . . 0.0 109.663 175.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -88.41 1.2 55.22 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.162 174.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -104.23 110.61 22.89 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.789 -174.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p -150.91 139.97 21.08 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.891 178.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.951 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.0 p90 -136.53 153.18 51.08 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -89.05 130.29 35.53 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.331 -175.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.541 HG22 ' CE2' ' A' ' 7' ' ' PHE . 3.3 t -114.5 131.58 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.314 178.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 80.4 mt-30 -100.68 108.08 19.85 Favored 'General case' 0 N--CA 1.428 -1.557 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 162.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.755 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.06 113.98 40.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.591 ' HB2' HG13 ' A' ' 102' ' ' ILE . 83.2 m-70 -68.07 144.88 54.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.168 -177.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -120.3 165.94 14.18 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.3 t -79.35 -25.01 12.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.973 0.416 . . . . 0.0 110.429 -178.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.471 ' HB2' ' CD2' ' A' ' 46' ' ' TYR . 2.6 m -78.3 161.84 68.75 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.309 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.422 ' O ' ' HB3' ' A' ' 17' ' ' GLU . 5.8 Cg_exo -79.41 -141.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.109 2.539 . . . . 0.0 112.239 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 16' ' ' PRO . 10.7 tp10 71.38 -67.85 0.24 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.22 0.608 . . . . 0.0 109.432 -173.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -151.09 105.4 2.99 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 174.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -59.5 -21.06 60.06 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.04 2.493 . . . . 0.0 112.799 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.597 HD11 ' HB3' ' A' ' 10' ' ' GLN . 54.3 tp -108.87 106.24 16.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.255 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.561 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 99.6 m -82.14 109.49 16.5 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.703 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.4 t -93.09 111.51 24.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.513 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.5 pt -124.13 175.9 6.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.053 0.454 . . . . 0.0 111.209 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.0 tttt -124.0 110.56 14.93 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -110.42 169.43 6.36 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.635 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.957 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.2 Cg_endo -74.36 142.52 30.16 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 121.608 1.539 . . . . 0.0 111.382 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.951 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.1 mtt180 -64.53 -1.44 1.79 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.175 0.512 . . . . 0.0 111.279 -175.175 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 m -112.88 -6.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.95 175.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.957 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.9 p -50.0 139.84 13.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.509 0.671 . . . . 0.0 111.717 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.559 ' CB ' ' HA ' ' A' ' 87' ' ' CYS . 4.2 t -118.33 174.05 6.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.328 174.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.58 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.7 -52.02 44.13 Favored 'General case' 0 C--O 1.213 -0.838 0 O-C-N 123.707 0.629 . . . . 0.0 111.183 -171.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.511 ' OE1' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -55.96 -33.81 65.11 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.564 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -76.07 -52.54 9.95 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.844 0.83 . . . . 0.0 110.46 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.594 ' CG1' HD22 ' A' ' 59' ' ' LEU . 6.0 p -64.43 -27.28 42.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 114.188 -1.369 . . . . 0.0 110.145 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.58 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.4 mm -56.46 -57.59 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.732 171.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 37.7 tp60 -66.97 -34.33 77.52 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.948 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -58.87 -43.02 90.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 120.542 0.211 . . . . 0.0 110.855 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.44 HG21 HD22 ' A' ' 103' ' ' LEU . 15.6 m -68.3 -34.69 76.6 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 35' ' ' ILE . 8.1 mp -54.6 -54.48 40.81 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.234 0.54 . . . . 0.0 110.472 172.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 52.2 t -64.63 -34.99 79.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.875 179.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.31 -37.35 87.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.221 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.82 ' HB1' ' HB2' ' A' ' 46' ' ' TYR . . . -106.18 15.45 26.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -171.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' A' ' 45' ' ' SER . 24.4 pttm -58.73 107.48 0.52 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.875 0.369 . . . . 0.0 110.587 177.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.878 ' HA ' HD21 ' A' ' 49' ' ' LEU . 97.3 m-85 69.52 -33.55 0.26 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.711 0.805 . . . . 0.0 111.319 -176.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.518 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 22.9 m -50.07 -64.23 0.87 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.827 0.851 . . . . 0.0 111.32 178.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.82 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 3.5 m-30 -96.15 19.19 12.15 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.422 ' C ' HD22 ' A' ' 49' ' ' LEU . 31.4 p 48.16 38.77 10.5 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.846 -172.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.478 ' O ' HD13 ' A' ' 49' ' ' LEU . 42.3 mm -84.96 76.07 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.61 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.878 HD21 ' HA ' ' A' ' 44' ' ' TYR . 1.9 mm? -122.87 -15.14 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.882 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -60.33 -43.67 96.21 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.751 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -121.1 92.63 48.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.142 172.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -81.72 -0.23 10.27 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.632 2.221 . . . . 0.0 110.926 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -97.98 125.66 43.24 Favored Pre-proline 0 N--CA 1.449 -0.496 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.654 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.511 ' HB2' ' OE1' ' A' ' 32' ' ' GLN . 94.0 Cg_endo -81.15 3.92 7.41 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.807 2.338 . . . . 0.0 112.324 -176.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 p -84.21 -26.84 28.43 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.798 -177.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 1.1 m-20 -89.9 4.93 48.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.147 0.499 . . . . 0.0 111.051 -173.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 38.3 m-85 -111.51 160.84 16.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.185 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.44 137.05 36.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.914 168.049 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.628 HD21 ' HB3' ' A' ' 101' ' ' PHE . 22.4 tp -89.94 140.51 29.55 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.205 0.526 . . . . 0.0 110.561 -177.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.569 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.6 mm? -101.67 128.89 47.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.731 178.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.602 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 14.3 pt-20 -92.18 84.25 5.21 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.353 1.073 . . . . 0.0 108.302 170.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.606 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 20.1 tt0 -86.08 121.86 29.29 Favored 'General case' 0 N--CA 1.425 -1.719 0 O-C-N 120.902 -1.124 . . . . 0.0 109.506 176.536 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.538 HG13 ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -104.37 104.47 16.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.358 174.059 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 61.3 t -63.93 106.66 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.808 179.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HG2' HG22 ' A' ' 63' ' ' VAL . 23.4 mmmt -104.02 92.15 4.26 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.808 -178.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -78.76 137.18 37.63 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.989 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.7 t -156.21 147.66 22.61 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.125 0.488 . . . . 0.0 110.342 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.523 ' HA ' ' HB ' ' A' ' 73' ' ' THR . 46.0 m -149.1 -59.41 0.22 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 32.0 m-20 57.4 -85.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.321 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -86.45 -62.94 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.065 -169.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -125.07 161.52 26.6 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -176.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.7 m -50.54 109.03 0.27 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.37 0.605 . . . . 0.0 111.687 -178.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.523 ' HB ' ' HA ' ' A' ' 68' ' ' THR . 34.4 m -131.03 138.25 49.54 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.432 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 39.8 p -76.97 140.38 66.65 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-O 120.732 0.301 . . . . 0.0 111.429 -176.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -61.58 148.06 93.91 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 123.193 2.596 . . . . 0.0 111.608 176.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -129.44 176.17 8.18 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.874 -171.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 83.7 p -141.44 119.99 12.44 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.538 ' HB3' HG13 ' A' ' 63' ' ' VAL . 22.7 t -91.0 102.64 15.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.606 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 34.7 tt0 -95.14 131.35 41.25 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.075 0.464 . . . . 0.0 110.226 -175.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.572 ' HD3' ' OE2' ' A' ' 61' ' ' GLU . 32.7 ttt-85 -127.0 151.9 47.96 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 1.065 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.17 140.14 27.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 118.851 0.75 . . . . 0.0 110.448 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.561 HD12 ' HB3' ' A' ' 59' ' ' LEU . 10.0 mt -93.69 165.5 12.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.551 0.691 . . . . 0.0 111.589 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.0 mp -96.12 -174.38 3.08 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.652 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.416 ' OD2' ' HG3' ' A' ' 32' ' ' GLN . 15.3 t70 -53.29 -51.11 63.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.275 0.559 . . . . 0.0 110.798 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.481 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 12.9 pt20 -125.84 55.54 1.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.574 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.0 tp10 -73.46 -23.03 60.03 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.602 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 7.5 m 76.0 132.15 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.013 -176.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.527 ' H ' ' HA ' ' A' ' 30' ' ' THR . 69.5 t -76.04 -42.81 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-O 121.176 0.512 . . . . 0.0 110.155 -174.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -73.0 -33.49 65.81 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.602 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 44.9 mt-30 -67.55 -36.79 81.65 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.157 173.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -45.35 70.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.557 0.694 . . . . 0.0 110.344 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -61.7 -32.57 72.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.816 -177.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.5 p -76.24 -16.11 59.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.648 0.261 . . . . 0.0 111.432 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 24.5 mmtp -74.67 -27.31 60.36 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.365 0.603 . . . . 0.0 110.016 176.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.41 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -55.68 144.67 26.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.765 -1.107 . . . . 0.0 113.695 -169.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -108.04 14.74 24.93 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.222 -1.354 . . . . 0.0 109.255 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.36 -166.59 30.38 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.611 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -107.46 107.97 19.08 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 117.54 0.67 . . . . 0.0 110.999 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.595 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -116.68 -147.47 8.73 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.575 -0.822 . . . . 0.0 111.777 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.652 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -152.05 160.46 43.44 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 173.697 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.755 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 85.9 m-85 -88.87 123.91 33.69 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 169.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.8 mp -103.07 121.97 54.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 121.952 -0.468 . . . . 0.0 110.188 -175.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.566 HD12 HD13 ' A' ' 35' ' ' ILE . 7.8 tp -79.31 112.07 16.18 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.635 ' HD2' HG23 ' A' ' 109' ' ' VAL . 17.7 ttmm -131.39 168.88 16.83 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 2.1 mp -91.53 161.17 15.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 14.3 ptmm? -88.27 -11.47 46.43 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 121.762 0.792 . . . . 0.0 109.486 174.148 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -79.01 -10.61 59.88 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.509 167.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -107.55 -39.22 5.68 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 1.065 HG11 HG11 ' A' ' 81' ' ' VAL . 56.6 t -99.14 91.53 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.528 169.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 1.1 tm0? -131.61 -79.0 0.52 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.517 1.151 . . . . 0.0 110.197 -177.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -168.88 63.17 0.06 Allowed 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 112.703 -2.044 . . . . 0.0 107.457 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 116' ' ' LYS . 9.4 m -54.02 103.76 0.09 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.125 -1.398 . . . . 0.0 112.136 -174.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -89.7 95.13 10.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 71.56 -57.32 0.61 Allowed 'General case' 0 N--CA 1.466 0.369 0 O-C-N 124.088 0.867 . . . . 0.0 110.412 -171.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -164.92 143.93 6.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.561 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 112' ' ' SER . 47.3 mmtm . . . . . 0 N--CA 1.467 0.396 0 O-C-N 123.581 0.551 . . . . 0.0 111.085 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.517 ' HB3' ' HG2' ' A' ' 5' ' ' GLU . 32.8 t -83.8 169.87 14.74 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.6 -16.26 17.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -99.06 13.49 32.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.207 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.517 ' HG2' ' HB3' ' A' ' 2' ' ' SER . 4.0 pt-20 -103.89 109.57 21.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.461 0.648 . . . . 0.0 111.063 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB2' ' HE2' ' A' ' 24' ' ' LYS . 17.4 m -156.48 131.39 9.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.938 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.91 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.0 p90 -114.4 157.31 23.04 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -87.95 133.73 33.87 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.002 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.546 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -118.69 129.56 74.76 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.442 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.736 ' HB3' HD11 ' A' ' 20' ' ' LEU . 79.7 mt-30 -96.97 108.03 20.67 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 163.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.724 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.88 118.95 56.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.33 0.586 . . . . 0.0 110.499 178.745 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.584 ' HB2' HG13 ' A' ' 102' ' ' ILE . 29.1 m-70 -76.13 140.38 41.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.935 -177.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -105.71 167.38 9.81 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 171.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.61 -13.44 8.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.315 0.579 . . . . 0.0 110.542 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.82 ' HB2' ' HB3' ' A' ' 46' ' ' TYR . 6.0 m -98.7 156.78 35.24 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.589 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_endo -86.09 139.84 6.42 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.997 2.464 . . . . 0.0 112.715 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 164.45 -64.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.599 -1.63 . . . . 0.0 106.599 -177.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.458 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.9 tp60 -151.62 84.73 5.02 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 168.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -46.02 -40.77 20.89 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.666 2.91 . . . . 0.0 113.197 -169.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.736 HD11 ' HB3' ' A' ' 10' ' ' GLN . 45.0 tp -89.72 103.1 15.78 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 172.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 50.6 m -83.36 108.05 16.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.419 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 56.5 t -95.65 111.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.546 HG13 ' HB ' ' A' ' 9' ' ' VAL . 12.8 pt -120.69 175.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.0 111.323 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 6' ' ' SER . 39.8 tttt -122.87 120.15 32.64 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 170.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -126.74 167.88 16.15 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -171.342 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.907 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.2 Cg_exo -68.2 139.59 46.63 Favored 'Trans proline' 0 N--CA 1.442 -1.52 0 C-N-CA 121.293 1.329 . . . . 0.0 111.429 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.91 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 42.3 mtt180 -66.72 -0.86 3.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.233 0.539 . . . . 0.0 110.701 -177.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.2 m -112.26 -9.1 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.979 174.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.907 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.5 p -46.45 139.59 4.85 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.891 0.853 . . . . 0.0 112.724 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.554 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 4.3 t -116.35 174.74 5.89 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.264 172.216 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.711 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.19 -50.79 48.28 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 123.579 0.55 . . . . 0.0 111.576 -171.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.512 ' OE1' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -57.94 -34.63 70.1 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.43 -177.805 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.33 -52.38 16.45 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.043 0.925 . . . . 0.0 110.084 -176.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.839 HG11 HD22 ' A' ' 59' ' ' LEU . 8.0 p -65.09 -27.94 43.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.261 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.711 HG12 ' O ' ' A' ' 31' ' ' ALA . 7.2 mm -56.77 -58.97 3.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.378 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 63.1 tt0 -73.77 -32.49 63.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.509 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.7 -42.72 84.31 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 120.781 0.324 . . . . 0.0 110.156 174.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.3 m -66.32 -38.06 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.017 175.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.574 HD13 ' O ' ' A' ' 35' ' ' ILE . 7.8 mp -53.5 -44.25 68.9 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.804 173.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 41.1 t -63.19 -34.14 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.258 0.551 . . . . 0.0 111.026 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -80.48 -21.58 41.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.216 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.553 ' HA ' ' HD1' ' A' ' 46' ' ' TYR . . . -105.67 -10.12 16.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -172.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 21.0 pttm -59.33 113.88 2.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.828 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.796 ' HA ' HD21 ' A' ' 49' ' ' LEU . 82.7 m-85 70.71 -43.67 0.56 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.016 0.927 . . . . 0.0 110.964 -176.341 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.3 m -45.54 -60.5 2.15 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 123.949 0.9 . . . . 0.0 111.156 177.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.82 ' HB3' ' HB2' ' A' ' 15' ' ' SER . 19.7 m-85 -102.15 18.58 20.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 177.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.454 ' C ' HD22 ' A' ' 49' ' ' LEU . 38.7 p 48.72 35.6 6.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.667 -172.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.454 ' O ' HD13 ' A' ' 49' ' ' LEU . 41.7 mm -82.93 79.15 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.173 172.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.796 HD21 ' HA ' ' A' ' 44' ' ' TYR . 2.2 mm? -121.78 -13.61 8.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.163 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.2 m -66.68 -46.78 74.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.958 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -122.22 87.11 47.88 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.548 175.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.46 8.25 4.11 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.313 2.675 . . . . 0.0 111.574 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -100.44 127.72 32.16 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.334 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.512 ' HB2' ' OE1' ' A' ' 32' ' ' GLN . 98.4 Cg_endo -81.23 5.91 5.94 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.888 2.392 . . . . 0.0 113.529 -174.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.502 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 13.2 p -79.19 -35.33 41.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.007 -175.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.533 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 60.5 m-20 -92.55 10.98 28.03 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -173.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 35' ' ' ILE . 42.2 m-85 -113.09 151.9 30.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.066 0.46 . . . . 0.0 111.1 -175.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -138.8 142.92 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.765 170.732 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.839 HD22 HG11 ' A' ' 34' ' ' VAL . 19.6 tp -94.57 142.56 27.31 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.015 0.436 . . . . 0.0 110.014 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.543 HD12 ' HG2' ' A' ' 79' ' ' GLN . 2.1 mm? -106.45 125.06 50.52 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.633 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.655 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -88.62 85.47 6.82 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 122.505 1.145 . . . . 0.0 108.351 171.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.544 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 1.8 tm-20 -87.14 121.73 29.99 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.592 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -109.51 112.4 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.464 176.184 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.651 HG23 ' HA2' ' A' ' 99' ' ' GLY . 61.1 t -65.78 107.42 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.343 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.537 ' HD3' ' HB2' ' A' ' 96' ' ' LYS . 23.4 mmmt -107.64 93.77 4.72 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.566 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.407 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 6.6 p-10 -80.51 140.59 35.8 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 172.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -141.19 41.04 1.78 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.632 -172.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.714 ' HA ' ' HB ' ' A' ' 73' ' ' THR . 31.5 m -59.92 -59.45 5.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 174.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 60.2 -80.61 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.506 173.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -110.46 -36.07 5.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.422 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.411 ' NZ ' ' HB2' ' A' ' 71' ' ' LYS . 4.9 ttmp? -138.17 156.24 47.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -177.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.7 m -50.48 98.9 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.333 0.587 . . . . 0.0 111.358 179.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.714 ' HB ' ' HA ' ' A' ' 68' ' ' THR . 74.3 m -125.11 133.52 52.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.195 -0.911 . . . . 0.0 108.949 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.444 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 39.5 p -71.3 135.08 84.56 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-O 120.899 0.381 . . . . 0.0 111.012 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 31.6 Cg_exo -63.14 161.1 31.48 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.262 2.642 . . . . 0.0 111.997 178.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -136.15 165.76 24.97 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -174.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.1 p -129.86 104.09 7.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.009 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.519 ' HB3' HG13 ' A' ' 63' ' ' VAL . 26.9 t -82.23 100.19 9.73 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.543 ' HG2' HD12 ' A' ' 60' ' ' LEU . 7.3 tt0 -93.47 131.49 38.64 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.59 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 30.7 ttt-85 -126.35 150.44 48.55 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.868 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.48 144.21 16.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 118.979 0.809 . . . . 0.0 110.328 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.553 HD12 ' HB3' ' A' ' 59' ' ' LEU . 15.7 mt -101.62 149.64 23.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.872 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 83' ' ' LEU . 6.2 mp -83.26 172.31 12.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.599 171.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -48.02 -48.98 32.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.221 0.534 . . . . 0.0 110.983 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -119.52 38.84 3.76 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.17 -176.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.1 tp10 -71.01 -21.83 62.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.986 0.422 . . . . 0.0 109.923 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.572 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 43.8 m 76.14 125.22 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.962 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.554 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.2 t -76.39 -39.41 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.078 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -72.88 -33.93 66.36 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.572 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 42.6 mt-30 -67.11 -30.05 69.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.958 174.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.66 -42.58 50.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.342 0.591 . . . . 0.0 110.397 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -56.78 -37.67 71.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.742 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 71.7 p -72.39 -13.9 61.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.818 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -78.1 -27.73 48.49 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 110.588 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.489 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.1 m0 -55.69 139.24 45.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -166.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.537 ' HB2' ' HD3' ' A' ' 65' ' ' LYS . 88.8 mttt -109.59 14.12 23.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.787 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.84 176.13 45.04 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.747 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.69 99.08 10.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.692 0.746 . . . . 0.0 110.857 -177.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.651 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.97 -148.8 15.32 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.963 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.7 mptp? -150.15 155.61 40.11 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.744 ' HB3' HD21 ' A' ' 59' ' ' LEU . 99.2 m-85 -84.58 120.78 26.75 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 169.03 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.584 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -102.07 127.37 55.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.846 -0.534 . . . . 0.0 110.356 -174.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.427 HD12 HD13 ' A' ' 35' ' ' ILE . 8.9 tp -81.19 120.87 25.42 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.736 ' HD2' HG23 ' A' ' 109' ' ' VAL . 19.3 ttmm -140.63 175.64 9.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.2 mp -98.47 156.47 16.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HB3' HG13 ' A' ' 58' ' ' VAL . 19.2 ptmt -91.36 -5.91 53.78 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.092 0.949 . . . . 0.0 110.245 178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -91.25 -3.41 56.93 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.747 166.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -108.72 -40.26 5.12 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 175.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.868 HG11 HG11 ' A' ' 81' ' ' VAL . 51.2 t -86.12 93.6 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.371 166.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.78 -176.14 5.02 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 176.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.28 45.24 0.74 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.408 0.623 . . . . 0.0 109.842 176.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 46.2 m -69.35 118.7 12.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.536 -174.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -75.54 115.82 15.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.598 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 66.44 -70.12 0.11 Allowed 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.93 0.769 . . . . 0.0 110.76 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -164.55 134.51 3.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.611 0.243 . . . . 0.0 110.556 175.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm . . . . . 0 N--CA 1.466 0.354 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.246 -179.231 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.5 m . . . . . 0 N--CA 1.477 0.925 0 CA-C-O 120.815 0.34 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.7 p -159.18 149.31 19.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.386 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -82.16 -28.8 31.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.385 0.612 . . . . 0.0 109.594 175.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -81.23 157.34 25.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.291 177.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.8 tt0 -123.5 138.77 54.51 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.313 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.1 m -97.88 138.01 35.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.972 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.593 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.3 p90 -104.3 150.0 24.84 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -80.53 120.67 24.81 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.189 -174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.571 ' HB ' HG13 ' A' ' 23' ' ' ILE . 19.1 t -107.06 135.53 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.424 175.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.577 ' HB3' HD11 ' A' ' 20' ' ' LEU . 48.4 mt-30 -112.69 109.04 18.3 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 165.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.731 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -131.49 122.82 51.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.112 -175.461 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.581 ' CD2' HD13 ' A' ' 20' ' ' LEU . 42.3 m-70 -79.69 145.01 33.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.811 -176.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -123.34 167.79 13.34 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.093 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 31.2 m -79.4 -1.51 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.468 ' HB2' ' HB2' ' A' ' 46' ' ' TYR . 38.8 t -81.39 147.32 59.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.118 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.57 -173.16 1.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.173 2.582 . . . . 0.0 110.613 169.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 61.41 77.85 0.31 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -177.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 64.95 72.75 0.46 Allowed Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.616 -172.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.32 -31.07 53.44 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.014 2.476 . . . . 0.0 112.036 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.581 HD13 ' CD2' ' A' ' 12' ' ' HIS . 51.9 tp -81.94 99.91 9.36 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.8 m -75.19 109.51 8.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.278 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -94.73 115.75 34.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.571 HG13 ' HB ' ' A' ' 9' ' ' VAL . 1.6 pt -130.97 130.06 63.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.363 -177.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -84.5 96.05 9.0 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -107.28 162.15 20.69 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.336 -173.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.869 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.6 Cg_exo -65.29 144.76 81.75 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.747 1.631 . . . . 0.0 112.158 -171.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.593 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 18.7 mtp180 -60.22 -11.28 5.9 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.609 0.719 . . . . 0.0 110.214 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.87 -4.41 9.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.46 177.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.869 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.8 p -58.33 124.6 20.05 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.495 0.664 . . . . 0.0 110.777 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.56 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.7 t -106.06 177.88 4.73 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.261 172.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.708 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.63 -50.33 24.72 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 123.564 0.54 . . . . 0.0 111.938 -171.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.691 ' HA ' HD12 ' A' ' 35' ' ' ILE . 4.8 pp0? -71.44 -27.56 63.35 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.634 -176.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.88 -49.34 53.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.895 0.855 . . . . 0.0 109.158 178.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 31' ' ' ALA . 2.3 p -69.18 -27.65 35.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.941 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.752 HD13 ' HB2' ' A' ' 57' ' ' TYR . 12.2 mt -56.64 -57.69 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.459 170.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.533 ' HB2' ' HG3' ' A' ' 54' ' ' PRO . 36.3 tt0 -66.1 -32.19 73.5 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.866 -176.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -59.44 -45.91 90.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-O 121.373 0.606 . . . . 0.0 109.686 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.4 m -64.82 -39.59 93.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.081 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.2 mp -50.79 -43.79 58.77 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.063 0.459 . . . . 0.0 110.828 173.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 86.0 m -63.46 -43.95 95.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.749 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -79.64 -16.41 55.83 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.92 11.71 34.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.503 0.192 . . . . 0.0 111.089 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.884 ' HA ' HD21 ' A' ' 49' ' ' LEU . 37.1 ttmt -58.68 103.61 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.671 -177.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.51 ' HD2' ' HG2' ' A' ' 43' ' ' LYS . 98.1 m-85 59.95 21.12 10.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.538 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.3 m -77.88 -81.76 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.223 0.535 . . . . 0.0 109.894 174.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 15' ' ' SER . 37.4 t80 -95.27 6.9 47.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.417 -0.956 . . . . 0.0 108.417 174.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.1 t 62.34 65.23 0.88 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.45 -176.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.49 HG22 ' O ' ' A' ' 48' ' ' ILE . 48.8 mm -90.37 12.55 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.98 1.371 . . . . 0.0 108.222 173.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.884 HD21 ' HA ' ' A' ' 43' ' ' LYS . 1.5 mm? -91.9 10.19 29.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.334 -170.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.2 m -71.66 -28.58 63.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.074 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.437 ' HB2' ' CE1' ' A' ' 57' ' ' TYR . 18.7 m120 -131.34 91.58 34.72 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.42 5.62 4.56 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.217 1.945 . . . . 0.0 112.717 -176.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.434 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.5 p-10 -108.94 132.3 21.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.658 ' HB2' ' HB2' ' A' ' 32' ' ' GLN . 3.4 Cg_exo -76.21 18.35 0.67 Allowed 'Trans proline' 0 CA--C 1.528 0.189 0 C-N-CA 123.167 2.578 . . . . 0.0 112.493 -178.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.6 m -90.21 -38.31 13.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.343 -173.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.522 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.0 m-20 -88.48 2.77 52.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.95 -176.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.752 ' HB2' HD13 ' A' ' 35' ' ' ILE . 16.4 m-85 -104.54 175.32 5.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.352 0.596 . . . . 0.0 110.189 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.505 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -144.28 180.0 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.339 169.838 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 1.081 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.7 tm? -144.19 137.51 27.45 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 -176.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.639 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.49 127.33 46.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.82 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.609 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.2 pt-20 -93.21 84.24 4.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.476 1.132 . . . . 0.0 108.549 169.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.627 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 7.3 tt0 -86.0 123.35 31.23 Favored 'General case' 0 N--CA 1.426 -1.659 0 O-C-N 121.624 -0.672 . . . . 0.0 109.956 176.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.532 HG22 ' HG2' ' A' ' 65' ' ' LYS . 0.2 OUTLIER -113.77 116.13 51.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.086 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.647 HG23 ' HA2' ' A' ' 99' ' ' GLY . 97.4 t -70.9 106.98 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.29 0.567 . . . . 0.0 110.601 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.532 ' HG2' HG22 ' A' ' 63' ' ' VAL . 23.6 mmmt -118.15 91.25 3.52 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.342 177.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.658 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 7.8 p-10 -58.5 172.87 0.44 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.729 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.8 t -95.38 103.79 15.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.171 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.8 m -65.52 -36.51 84.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.496 0.665 . . . . 0.0 109.9 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -97.17 -137.56 0.27 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -128.29 90.09 3.02 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.266 0.555 . . . . 0.0 112.073 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -102.71 -32.65 9.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.714 169.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -137.61 153.98 49.82 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.272 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 10.0 t -66.61 -29.12 69.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.133 0.492 . . . . 0.0 110.325 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.0 p -119.25 161.79 35.19 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.084 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -54.06 151.34 28.01 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.438 2.092 . . . . 0.0 111.929 172.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.658 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 22.4 pttp -120.46 151.83 38.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.152 0.501 . . . . 0.0 111.775 -169.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 50.4 m -114.87 124.45 51.76 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.771 -177.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.9 t -87.27 98.66 11.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.627 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 49.5 tt0 -97.7 131.67 44.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.726 -174.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.536 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 2.3 tmt_? -128.04 148.7 50.56 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.738 HG11 HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.63 133.77 51.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 118.665 0.666 . . . . 0.0 111.005 -177.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.669 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 9.3 mt -93.14 166.61 12.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.394 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.469 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.7 mp -95.49 -176.8 3.88 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 165.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -59.67 -32.61 70.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.41 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 6.3 pt20 -125.28 38.58 4.15 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -176.38 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.669 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 13.3 mm-40 -75.38 -12.7 60.31 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.019 171.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.62 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 63.6 m 68.95 121.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.445 0.64 . . . . 0.0 111.943 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.56 ' H ' ' HA ' ' A' ' 30' ' ' THR . 74.9 t -75.75 -39.79 39.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.183 -173.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -72.58 -38.22 67.94 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.62 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 36.4 mt-30 -58.27 -46.77 85.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.51 172.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.18 -46.84 87.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.729 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -60.56 -26.98 67.32 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.181 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 t -75.12 -20.71 59.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -77.13 -23.12 51.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.361 0.6 . . . . 0.0 110.311 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.45 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.7 m0 -60.47 133.37 56.03 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.427 -172.208 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -113.16 11.85 18.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.695 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -156.77 167.78 33.73 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 109.081 -1.608 . . . . 0.0 109.081 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.77 105.65 17.94 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 118.02 0.91 . . . . 0.0 110.702 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.647 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -110.52 -142.84 9.4 Favored Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.586 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -158.1 160.32 37.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.104 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 1.081 ' HB3' HD11 ' A' ' 59' ' ' LEU . 95.8 m-85 -89.35 151.87 21.83 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 169.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.9 mp -132.69 128.89 58.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 O-C-N 121.933 -0.479 . . . . 0.0 110.465 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.438 HD11 HG12 ' A' ' 35' ' ' ILE . 12.8 tp -84.1 136.8 33.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.578 ' HD2' HG23 ' A' ' 109' ' ' VAL . 22.1 ttmm -154.27 165.31 36.72 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -89.04 149.78 23.07 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 169.71 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.2 ptmm? -78.17 -28.62 48.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.172 0.51 . . . . 0.0 109.947 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.29 -13.89 61.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.479 0.657 . . . . 0.0 109.731 172.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -100.17 -9.38 22.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.738 HG21 HG11 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -96.85 -16.74 7.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.674 -178.767 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.434 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 27.3 pt20 -58.33 88.03 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 122.256 1.027 . . . . 0.0 112.114 -171.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -118.74 1.17 11.57 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.737 175.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.1 t -139.1 99.74 3.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.887 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 24.4 mmt85 66.75 -176.22 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.976 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -75.57 138.13 41.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.448 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -73.73 -31.72 63.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 -177.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 20.0 pttm . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.004 -178.934 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 120.999 0.428 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -89.84 26.17 1.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 47.08 58.62 4.64 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.339 -167.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.45 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 1.5 mp0 -21.64 109.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 O-C-N 125.364 1.665 . . . . 0.0 112.933 -178.253 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -103.68 132.11 50.24 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.056 -173.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 p -111.69 169.61 8.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.033 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.883 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.1 p90 -130.2 149.8 51.74 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.413 ' CZ ' ' HD3' ' A' ' 24' ' ' LYS . 68.4 m-85 -89.42 138.31 31.56 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.858 -177.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.514 HG22 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -126.49 158.09 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.092 0.472 . . . . 0.0 109.888 176.265 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.513 ' HB2' HD11 ' A' ' 20' ' ' LEU . 5.2 pm0 -129.63 107.46 9.46 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 163.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -118.36 139.63 44.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.727 -174.692 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 -81.93 118.61 23.09 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.031 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -82.64 167.44 18.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.091 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.2 t -62.75 -36.58 76.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.104 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 p -71.2 122.53 87.29 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 111.308 -176.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.03 -170.05 0.85 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.415 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 73.16 -38.92 0.43 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.99 0.916 . . . . 0.0 111.236 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.512 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 5.9 tp60 -116.9 83.44 14.53 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 165.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -65.0 -53.16 0.93 Allowed 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 123.023 2.482 . . . . 0.0 112.673 -170.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.513 HD11 ' HB2' ' A' ' 10' ' ' GLN . 40.4 tp -90.89 116.97 29.12 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.054 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.8 m -95.96 106.85 19.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.768 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.8 t -85.08 120.64 35.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.2 pt -130.92 168.73 23.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.891 0.377 . . . . 0.0 110.783 -177.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.413 ' HD3' ' CZ ' ' A' ' 8' ' ' PHE . 18.7 ttpp -124.87 111.93 16.05 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.031 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -117.92 164.73 18.53 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.002 -175.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.697 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 5.8 Cg_exo -68.23 143.91 60.67 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 122.203 1.936 . . . . 0.0 111.993 -179.082 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.883 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 44.7 mtp180 -64.81 -3.64 3.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.532 0.682 . . . . 0.0 110.449 -176.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.43 -7.9 11.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.697 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 0.8 OUTLIER -55.62 123.18 13.22 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 121.484 0.659 . . . . 0.0 111.875 174.508 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.615 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.2 t -100.47 178.91 4.6 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.96 170.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.532 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.34 -51.4 19.59 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.607 0.567 . . . . 0.0 111.238 -172.302 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.89 -32.05 72.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -177.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.64 -52.19 16.41 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.787 0.803 . . . . 0.0 109.368 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.418 ' CG1' HD22 ' A' ' 59' ' ' LEU . 2.3 p -66.91 -29.29 45.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.064 -178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.891 HD13 ' HG ' ' A' ' 103' ' ' LEU . 5.7 mm -56.93 -58.39 5.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.086 172.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.449 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.2 tt0 -68.51 -32.04 71.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.699 -175.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 41' ' ' LYS . 6.3 tp60 -63.8 -37.4 87.25 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 120.985 0.422 . . . . 0.0 109.976 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 27.7 m -70.53 -36.03 73.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.88 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.9 mp -55.45 -36.57 66.7 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.445 0.641 . . . . 0.0 110.375 172.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.9 m -70.45 -38.58 74.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.105 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 75.1 mmtt -71.02 -28.09 64.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.788 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 6.74 47.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.557 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.476 ' HD2' ' HB2' ' A' ' 44' ' ' TYR . 6.0 tmmm? -59.95 121.57 12.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.912 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t80 78.29 -31.45 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.183 0.993 . . . . 0.0 110.99 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -63.41 117.32 6.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 176.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.7 t80 65.39 8.69 5.16 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.684 0.754 . . . . 0.0 109.671 -177.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.453 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 13.4 p 43.14 75.46 0.09 Allowed 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.421 -172.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.8 tt -85.8 7.78 2.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.686 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.912 HD21 ' HA ' ' A' ' 44' ' ' TYR . 1.1 mm? -70.91 -10.56 59.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.741 -171.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 m -70.23 -20.87 63.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 109.969 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -139.57 69.73 38.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.974 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -91.54 11.25 2.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.476 2.784 . . . . 0.0 112.618 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.441 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.3 OUTLIER -98.66 126.17 39.96 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.39 177.614 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 89.6 Cg_endo -93.51 2.04 3.32 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.052 2.502 . . . . 0.0 114.149 -173.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.9 t -71.39 -33.81 69.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.608 0.242 . . . . 0.0 111.328 -174.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.655 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.2 OUTLIER -82.6 7.02 15.79 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 0.0 111.565 -178.482 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.584 ' HB3' HD12 ' A' ' 35' ' ' ILE . 6.7 m-85 -106.77 137.9 43.94 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.227 -176.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.717 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.8 OUTLIER -118.83 165.71 13.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 165.827 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.511 HD11 ' HB3' ' A' ' 101' ' ' PHE . 13.9 tp -117.89 138.46 52.11 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.297 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.559 HD13 ' HA ' ' A' ' 81' ' ' VAL . 2.6 mm? -98.51 126.08 43.95 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.703 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.1 pt-20 -88.66 86.43 6.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.596 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 10.8 tt0 -86.98 121.93 30.12 Favored 'General case' 0 N--CA 1.423 -1.817 0 O-C-N 120.702 -1.249 . . . . 0.0 108.733 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.501 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.4 OUTLIER -106.03 115.84 48.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 CA-C-O 121.425 0.631 . . . . 0.0 109.366 174.742 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.72 HG23 ' HA2' ' A' ' 99' ' ' GLY . 53.4 t -85.49 98.41 6.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.217 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.416 ' HG3' ' HB2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -81.9 65.95 7.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.519 1.152 . . . . 0.0 108.644 174.142 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.4 ' HB2' HG12 ' A' ' 64' ' ' VAL . 1.9 t70 -75.72 146.76 39.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.955 -175.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.9 t -68.74 131.76 45.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.418 0.628 . . . . 0.0 111.403 -176.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 m -100.6 -4.12 29.14 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.513 0.673 . . . . 0.0 109.543 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -96.54 -173.75 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.527 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -146.54 78.66 1.51 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.227 0.537 . . . . 0.0 111.456 177.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -172.88 -51.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.48 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.1 t -148.25 174.64 11.79 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.645 -178.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m 71.26 107.08 0.06 Allowed 'General case' 0 C--N 1.333 -0.13 0 O-C-N 123.708 0.63 . . . . 0.0 110.529 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.9 p -84.46 160.11 57.33 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.739 -178.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.05 125.91 18.86 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.332 2.021 . . . . 0.0 111.496 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HB2' ' HG3' ' A' ' 65' ' ' LYS . 13.9 mmmm -118.9 144.08 46.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.929 -175.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 12.7 p -119.76 121.06 38.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.674 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.48 ' HB2' HG13 ' A' ' 63' ' ' VAL . 20.3 m -104.27 103.06 12.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.587 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 16.2 tt0 -95.77 130.78 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -175.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -132.06 131.38 42.37 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.559 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -88.92 137.18 21.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.446 -173.885 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.509 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 17.9 mt -97.37 159.96 14.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.707 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.628 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 7.7 mp -86.92 -169.63 2.71 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 165.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.11 -36.12 82.31 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.695 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.478 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 12.0 pt20 -125.11 44.6 2.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.628 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 8.1 mm-40 -77.33 -9.66 58.97 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 122.174 -0.329 . . . . 0.0 110.875 172.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.684 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 16.7 t 74.41 129.32 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.088 0.955 . . . . 0.0 111.415 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.615 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.6 t -78.54 -46.85 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 109.778 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -72.41 -41.4 66.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.505 -174.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.684 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 7.4 mm100 -63.26 -45.0 93.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.658 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.99 -51.26 69.95 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 110.493 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -55.49 -36.51 66.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.125 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.5 t -72.25 -15.73 61.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.454 -177.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 68.4 mmtt -90.9 -13.01 34.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.329 0.585 . . . . 0.0 110.737 -178.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 42.1 m0 -59.01 152.35 20.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.177 -174.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.489 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.3 mppt? -109.05 15.79 23.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.422 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -179.91 176.38 47.41 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 114.618 -1.174 . . . . 0.0 110.603 -176.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.485 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -94.38 106.63 18.61 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.512 0.656 . . . . 0.0 110.925 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.72 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.89 -146.76 13.48 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.073 -177.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -149.39 137.66 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.559 ' HB2' HG12 ' A' ' 11' ' ' VAL . 98.0 m-85 -84.34 146.31 27.78 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.521 -0.872 . . . . 0.0 109.324 169.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 71.3 mt -135.61 129.61 49.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 O-C-N 122.079 -0.388 . . . . 0.0 111.587 -171.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.891 ' HG ' HD13 ' A' ' 35' ' ' ILE . 9.1 mp -79.61 107.93 12.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 110.009 174.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.527 ' HG2' HG23 ' A' ' 109' ' ' VAL . 32.2 ttpt -138.26 128.86 26.45 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.537 HD22 ' O ' ' A' ' 56' ' ' ASP . 19.3 mt -62.32 139.72 58.52 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.624 0.726 . . . . 0.0 112.895 -171.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.717 ' HB3' HG13 ' A' ' 58' ' ' VAL . 13.9 ptmm? -70.95 -30.02 66.21 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.481 179.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.461 ' OE1' ' HG3' ' A' ' 106' ' ' LYS . 7.4 mm-40 -69.99 -14.8 62.87 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -111.24 -21.67 11.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.542 175.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.535 ' HB ' ' HA ' ' A' ' 106' ' ' LYS . 1.1 t -79.08 -27.32 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.317 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 8.4 mm-40 -52.3 91.24 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.812 0.815 . . . . 0.0 112.872 -173.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -139.66 11.99 2.5 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.179 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.5 m -67.26 105.4 1.73 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.339 -1.301 . . . . 0.0 111.079 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' A' ' 113' ' ' ARG . 17.8 mtp180 -128.72 -48.15 1.26 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.578 176.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.9 -65.02 1.02 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.046 -177.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -90.65 132.53 35.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.424 0.63 . . . . 0.0 110.063 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.759 -175.816 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.03 0.443 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 p 179.37 -160.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.53 -33.34 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -72.7 125.76 28.27 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.838 173.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.486 ' OE2' ' HD2' ' A' ' 27' ' ' ARG . 29.3 tt0 -104.82 141.12 37.07 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.21 -170.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.506 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m -91.01 133.33 35.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 168.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HB3' HD11 ' A' ' 20' ' ' LEU . 41.5 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.797 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.548 ' HB2' HG13 ' A' ' 102' ' ' ILE . 78.2 m-70 -77.26 143.52 38.85 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -135.48 170.22 16.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.492 ' CG2' HD11 ' A' ' 48' ' ' ILE . 10.4 m -86.24 -1.08 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-O 120.632 0.253 . . . . 0.0 111.584 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -62.48 128.89 92.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.984 0.421 . . . . 0.0 110.295 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.7 170.48 19.92 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.024 2.483 . . . . 0.0 113.011 -176.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 18' ' ' GLN . 11.8 tp10 61.43 94.2 0.04 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.927 -175.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 13.2 mm-40 66.33 76.52 0.29 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.146 -170.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.21 -32.1 93.96 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.677 2.251 . . . . 0.0 111.195 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp -80.8 106.45 12.81 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.618 174.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.58 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.862 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.675 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 35' ' ' ILE . 4.8 pp0? -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.535 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.832 HD13 ' HB2' ' A' ' 57' ' ' TYR . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -116.07 16.77 16.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.867 ' HA ' HD21 ' A' ' 49' ' ' LEU . 36.2 ttmt -62.45 110.15 1.58 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.237 -176.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.512 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 32.8 m-85 70.7 -12.32 0.56 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.579 1.152 . . . . 0.0 112.142 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.4 m -54.72 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -178.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -99.05 6.78 46.45 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.42 ' C ' ' H ' ' A' ' 49' ' ' LEU . 30.3 t 57.45 42.72 24.16 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.275 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.492 HD11 ' CG2' ' A' ' 14' ' ' VAL . 22.5 mm -63.52 -9.6 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.832 171.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.867 HD21 ' HA ' ' A' ' 43' ' ' LYS . 1.3 mm? -73.24 9.51 1.25 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.102 -1.408 . . . . 0.0 111.557 -171.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -59.94 -32.41 70.77 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 173.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -120.55 86.01 39.0 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.78 7.05 3.34 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.275 1.983 . . . . 0.0 113.012 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -113.77 136.84 22.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.929 178.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.455 ' HB3' ' HB2' ' A' ' 36' ' ' GLN . 65.6 Cg_endo -75.61 7.51 3.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.122 2.548 . . . . 0.0 112.869 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.453 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 4.2 m -88.23 -13.2 41.62 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.864 -174.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.518 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 37.2 m-20 -109.94 15.02 22.87 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 -176.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' ' 35' ' ' ILE . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.598 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 1.044 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.735 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.648 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.543 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t -67.72 112.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.437 ' HG2' HG22 ' A' ' 63' ' ' VAL . 24.7 mmmt -123.12 95.13 4.49 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.788 -1.096 . . . . 0.0 108.973 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 6.8 p-10 -60.77 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.402 -175.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.8 t -122.93 114.32 20.28 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.389 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 m -69.61 -36.62 76.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.212 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -87.02 -152.37 0.19 Allowed 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 70' ' ' LYS . 48.3 mtpt -113.81 81.51 1.54 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.199 0.523 . . . . 0.0 110.975 173.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -104.76 -31.57 9.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.602 173.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.494 HG22 ' H ' ' A' ' 74' ' ' THR . 14.5 m -139.33 143.87 38.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.386 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -64.61 -19.73 65.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.0 111.215 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.494 ' H ' HG22 ' A' ' 72' ' ' THR . 7.3 p -137.8 160.42 64.84 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.859 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.7 133.61 45.03 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.277 1.985 . . . . 0.0 111.598 172.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.582 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 21.3 pttp -112.87 164.92 12.82 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.61 -168.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m -113.63 139.98 48.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.008 -177.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.611 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 36.4 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.51 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.664 HG11 HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.411 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.657 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.641 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.57 ' H ' ' HA ' ' A' ' 30' ' ' THR . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 1.9 mt-30 -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.496 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.482 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.648 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 1.044 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.735 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.598 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmm? -84.95 -19.69 31.77 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.67 -13.43 60.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.562 168.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -103.15 -8.87 20.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.307 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.664 HG21 HG11 ' A' ' 81' ' ' VAL . 0.5 OUTLIER -101.21 7.72 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.08 176.434 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -50.73 89.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 113.529 -168.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.27 18.04 0.48 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.285 -1.325 . . . . 0.0 107.991 171.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.5 t -104.81 60.61 0.69 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.861 -172.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.421 ' HB2' ' H ' ' A' ' 114' ' ' GLU . 13.6 mmt180 60.31 -92.53 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.328 175.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.421 ' H ' ' HB2' ' A' ' 113' ' ' ARG . 8.6 tp10 -147.97 143.52 27.36 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -113.86 -39.83 3.9 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.932 0.396 . . . . 0.0 110.754 -176.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.5 pttp . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.198 -177.274 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.4 t . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m -140.06 130.04 24.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -79.03 -47.0 17.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.238 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -77.97 128.59 34.13 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 120.809 0.338 . . . . 0.0 110.645 175.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.87 116.52 31.38 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.533 0.683 . . . . 0.0 109.308 178.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.588 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 11.6 m -153.25 160.68 42.81 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.109 173.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.664 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 9.2 p90 -135.76 149.53 49.19 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -83.77 121.48 27.36 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.303 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' HG13 ' A' ' 23' ' ' ILE . 9.2 t -99.78 128.73 51.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.056 0.455 . . . . 0.0 110.38 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.55 ' HG3' HD11 ' A' ' 20' ' ' LEU . 61.7 tt0 -100.16 106.59 18.31 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 166.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.679 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -135.47 137.16 50.13 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.242 -176.383 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -93.19 -168.86 2.01 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.127 0.418 . . . . 0.0 112.127 -173.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 72.19 92.81 0.08 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 124.479 1.112 . . . . 0.0 111.148 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.469 HG13 ' N ' ' A' ' 15' ' ' SER . 6.8 p -159.11 -56.88 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.55 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.469 ' N ' HG13 ' A' ' 14' ' ' VAL . 7.2 p -162.15 156.85 19.25 Favored Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 122.309 -0.244 . . . . 0.0 110.457 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -64.57 -43.24 13.85 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.274 1.983 . . . . 0.0 111.731 176.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.13 131.98 34.73 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 170.248 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 57.99 75.16 0.56 Allowed Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -166.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -77.9 26.1 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.196 2.597 . . . . 0.0 112.116 -176.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.55 HD11 ' HG3' ' A' ' 10' ' ' GLN . 46.1 tp -147.13 133.47 19.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.626 -175.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.3 m -104.06 110.26 22.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.193 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.8 p -99.75 128.29 51.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.301 0.572 . . . . 0.0 109.637 173.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.555 HG13 ' HB ' ' A' ' 9' ' ' VAL . 9.1 pt -137.66 159.97 34.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.696 -178.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.588 ' HE3' ' HB2' ' A' ' 6' ' ' SER . 18.8 tttp -114.48 97.8 6.52 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.457 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -110.31 169.31 6.5 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.055 -170.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.88 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.5 Cg_endo -71.9 140.1 34.44 Favored 'Trans proline' 0 N--CA 1.443 -1.442 0 C-N-CA 121.48 1.453 . . . . 0.0 110.612 -176.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.664 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 98.9 mtt180 -57.72 -36.48 72.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.8 -13.94 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 113.944 -1.48 . . . . 0.0 112.617 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.88 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 80.1 p -58.45 124.76 20.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.679 0.752 . . . . 0.0 110.757 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.552 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.2 t -100.66 179.63 4.36 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.927 171.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.67 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.51 -50.39 23.55 Favored 'General case' 0 C--O 1.209 -1.068 0 O-C-N 123.422 0.451 . . . . 0.0 110.745 -174.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.418 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.4 OUTLIER -59.69 -31.91 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -72.8 -53.35 11.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 122.168 0.985 . . . . 0.0 109.641 -176.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.682 HG11 HD22 ' A' ' 59' ' ' LEU . 2.6 p -65.42 -27.7 42.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.074 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.791 HD13 HD12 ' A' ' 103' ' ' LEU . 10.1 mm -56.74 -56.07 16.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.363 168.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.852 ' HA ' HD12 ' A' ' 39' ' ' LEU . 6.6 tp-100 -59.98 -45.49 92.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.941 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -59.1 -39.17 81.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.649 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.505 ' HB ' HD13 ' A' ' 103' ' ' LEU . 29.5 m -69.02 -41.13 78.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.73 0.3 . . . . 0.0 110.293 176.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 36' ' ' GLN . 29.7 mt -56.8 -38.84 73.11 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 120.986 0.422 . . . . 0.0 110.308 175.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.03 -52.98 44.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.783 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -80.34 -9.26 59.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.432 ' HB1' ' HB3' ' A' ' 47' ' ' SER . . . -131.33 28.27 4.7 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.396 -0.19 . . . . 0.0 111.097 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.533 ' HG3' ' CD1' ' A' ' 44' ' ' TYR . 3.4 tppp? -47.09 -74.53 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.239 0.616 . . . . 0.0 111.626 -174.077 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.533 ' CD1' ' HG3' ' A' ' 43' ' ' LYS . 73.5 m-85 -130.13 36.8 3.97 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 172.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 72.6 m -71.42 36.49 0.06 Allowed 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.81 -1.541 . . . . 0.0 112.381 -178.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 15.3 t80 55.94 36.34 27.15 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -166.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.432 ' HB3' ' HB1' ' A' ' 42' ' ' ALA . 60.1 m -124.45 -88.16 0.61 Allowed 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.407 -168.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.422 HD13 ' HA ' ' A' ' 48' ' ' ILE . 15.9 mm -82.18 -76.62 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.679 -176.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.518 ' HA ' ' CD2' ' A' ' 44' ' ' TYR . 4.6 mp 65.15 -41.66 0.31 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.5 p -59.62 -76.73 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -177.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -116.2 112.0 42.16 Favored Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.668 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -78.6 -17.49 12.62 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.647 2.231 . . . . 0.0 110.982 173.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.475 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 8.0 p-10 -85.41 134.78 39.69 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.602 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 1.2 Cg_endo -81.92 -6.59 12.31 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.737 2.291 . . . . 0.0 112.798 -174.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.403 ' O ' ' HD2' ' A' ' 106' ' ' LYS . 14.0 m -67.01 -6.28 16.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -174.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.539 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.7 m-20 -118.39 19.52 13.37 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.522 -0.177 . . . . 0.0 110.522 176.115 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.632 ' HB3' HD12 ' A' ' 35' ' ' ILE . 49.5 m-85 -123.24 143.92 49.73 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.397 0.618 . . . . 0.0 111.799 -175.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.649 HG13 ' HB3' ' A' ' 106' ' ' LYS . 3.1 m -127.66 165.99 25.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.411 166.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.682 HD22 HG11 ' A' ' 34' ' ' VAL . 12.2 tp -112.59 152.02 29.38 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.911 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.6 OUTLIER -109.3 140.19 43.28 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.042 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.686 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.1 pt-20 -105.58 87.14 2.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.117 0.961 . . . . 0.0 109.096 170.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.645 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.1 tt0 -86.58 123.72 32.09 Favored 'General case' 0 N--CA 1.42 -1.939 0 O-C-N 121.19 -0.944 . . . . 0.0 109.376 173.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.552 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -111.82 117.59 55.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.994 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.578 HG23 ' HA2' ' A' ' 99' ' ' GLY . 92.7 t -65.61 101.66 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 CA-C-O 121.601 0.715 . . . . 0.0 109.313 176.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.65 89.59 3.07 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.216 -172.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -89.5 -171.74 3.33 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.622 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 69' ' ' ASN . 5.9 t -142.8 162.46 35.41 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.267 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.3 t -71.91 -26.14 62.19 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -174.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.454 ' O ' HG23 ' A' ' 67' ' ' THR . 4.2 p-10 -123.75 152.69 41.87 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 120.74 0.305 . . . . 0.0 111.014 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -139.18 85.93 2.1 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.66 0.743 . . . . 0.0 112.632 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.4 ' HE3' ' HB3' ' A' ' 71' ' ' LYS . 24.3 mmmt -113.52 -60.59 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.004 170.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -110.23 -22.06 11.94 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.65 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.424 ' HB ' HG21 ' A' ' 67' ' ' THR . 17.5 p -94.66 111.71 23.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.435 178.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.9 p -100.15 150.26 36.74 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.705 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.79 131.97 40.23 Favored 'Trans proline' 0 CA--C 1.509 -0.726 0 C-N-CA 122.551 2.168 . . . . 0.0 110.973 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -156.66 146.16 20.65 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.219 -161.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.2 m -87.42 135.02 33.5 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.418 0.627 . . . . 0.0 112.007 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.7 m -102.96 100.0 9.93 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.605 171.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.645 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.0 tt0 -94.33 132.69 38.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.942 -174.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.607 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 6.2 tpp180 -127.73 160.71 30.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.79 HG11 HG11 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -115.71 144.71 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 118.381 0.537 . . . . 0.0 110.474 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.666 HD21 ' HB3' ' A' ' 61' ' ' GLU . 20.8 mt -104.84 152.07 23.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.672 -174.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.415 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 7.3 mp -81.36 169.67 16.94 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 166.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -41.39 62.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.9 0.381 . . . . 0.0 111.389 -176.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.437 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 14.1 pt20 -114.09 32.03 6.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.59 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 22.6 tp10 -63.39 -20.69 65.75 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.992 0.425 . . . . 0.0 110.331 175.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.619 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 73.9 m 72.09 122.27 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.208 178.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.552 ' H ' ' HA ' ' A' ' 30' ' ' THR . 90.9 t -75.27 -38.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.25 -171.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -72.92 -33.96 66.29 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.619 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.8 OUTLIER -65.43 -40.57 93.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.192 176.781 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.515 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -68.88 -40.32 79.32 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.687 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.63 -36.03 79.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.135 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -70.51 -15.36 62.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.545 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 88.6 mttt -75.55 -24.98 56.75 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.011 0.434 . . . . 0.0 110.434 177.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.443 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.1 m0 -63.68 153.95 34.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -167.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mtmm -135.81 24.99 3.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.176 -1.375 . . . . 0.0 108.205 175.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.479 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -169.28 153.5 22.12 Favored Glycine 0 N--CA 1.44 -1.055 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.37 10.59 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.283 1.041 . . . . 0.0 111.062 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.578 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.38 -154.35 20.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.894 -176.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HB2' ' HE3' ' A' ' 100' ' ' LYS . 1.3 mtmt -146.32 143.88 29.43 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.679 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -80.42 153.06 28.5 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 169.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.911 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 92.9 mt -135.57 128.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 O-C-N 122.02 -0.425 . . . . 0.0 111.426 -173.336 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.791 HD12 HD13 ' A' ' 35' ' ' ILE . 3.4 tp -77.7 130.46 36.82 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.115 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 1.1 tppt? -151.61 175.79 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.568 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.7 mp -101.92 133.33 46.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.86 0.362 . . . . 0.0 110.416 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.649 ' HB3' HG13 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -63.52 -29.82 71.03 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.074 173.927 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -70.45 -22.28 62.71 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -100.63 -6.42 25.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.843 0.83 . . . . 0.0 108.898 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.79 HG11 HG11 ' A' ' 81' ' ' VAL . 69.9 t -124.08 31.63 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.899 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -77.99 65.51 3.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.624 -174.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.07 -9.26 34.24 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.195 -0.911 . . . . 0.0 108.916 172.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.9 m -57.56 132.32 52.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.868 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -164.12 -172.64 2.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.499 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 67.24 92.13 0.08 Allowed 'General case' 0 C--N 1.331 -0.21 0 O-C-N 124.009 0.818 . . . . 0.0 110.634 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.5 t70 70.84 155.15 0.14 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.496 -178.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.412 ' HB3' ' NZ ' ' A' ' 116' ' ' LYS . 6.8 ttpm? . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.624 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 120.814 0.34 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.485 ' HB3' ' OE2' ' A' ' 4' ' ' GLU . 45.4 m -127.73 105.29 8.35 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -101.72 8.82 41.41 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.52 -174.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.485 ' OE2' ' HB3' ' A' ' 2' ' ' SER . 6.7 pm0 -75.44 163.26 27.6 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.554 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 0.2 OUTLIER -102.89 133.47 47.92 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.189 0.519 . . . . 0.0 110.617 -172.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.7 p -118.75 139.8 50.97 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.219 0.533 . . . . 0.0 111.187 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.869 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -124.14 156.7 36.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.214 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.46 ' CZ ' ' HE2' ' A' ' 24' ' ' LYS . 43.7 m-85 -84.75 125.22 32.36 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.22 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.6 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.9 t -113.76 129.32 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.457 178.269 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.626 ' HB3' HD11 ' A' ' 20' ' ' LEU . 44.9 mt-30 -97.96 108.54 21.28 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 164.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.787 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -120.08 115.19 46.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-O 121.51 0.672 . . . . 0.0 110.406 177.831 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.63 ' CD2' HD13 ' A' ' 20' ' ' LEU . 9.4 m-70 -87.67 168.21 13.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.266 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.676 ' HB3' ' CE1' ' A' ' 46' ' ' TYR . 28.4 t70 -142.95 168.79 18.87 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 166.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -78.45 -22.58 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.931 0.396 . . . . 0.0 111.145 -176.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.969 ' HB2' ' HD1' ' A' ' 46' ' ' TYR . 12.7 m -65.14 148.49 97.84 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.821 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 -28.54 8.47 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.734 2.289 . . . . 0.0 113.826 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.74 113.16 7.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.287 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 60.26 79.7 0.28 Allowed Pre-proline 0 C--O 1.225 -0.234 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.836 -174.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -52.63 -44.59 46.44 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.336 2.024 . . . . 0.0 111.914 -177.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.63 HD13 ' CD2' ' A' ' 12' ' ' HIS . 27.0 tp -116.58 121.15 40.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.489 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.6 m -92.06 109.45 20.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 173.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 50.0 t -95.81 110.69 24.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.6 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.2 pt -116.68 168.28 8.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.891 0.377 . . . . 0.0 110.706 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HE2' ' CZ ' ' A' ' 8' ' ' PHE . 19.0 tttm -117.1 96.05 5.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 169.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -100.47 167.49 10.82 Favored Pre-proline 0 CA--C 1.506 -0.712 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.461 -175.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.887 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 5.6 Cg_exo -68.74 141.98 51.27 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 121.535 1.49 . . . . 0.0 111.523 -177.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.869 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 35.5 mtp180 -66.33 -0.45 2.64 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.601 0.715 . . . . 0.0 109.966 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.415 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.5 m -114.12 -2.44 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.461 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.887 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.2 p -59.86 119.69 8.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.277 0.561 . . . . 0.0 109.859 175.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.496 ' C ' HG23 ' A' ' 88' ' ' VAL . 17.8 p -94.15 -173.82 3.21 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -55.8 -49.92 71.89 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.711 -176.162 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -30.71 71.08 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -178.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -70.68 -53.74 14.54 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.485 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 31' ' ' ALA . 2.2 p -66.59 -27.6 40.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 113.599 -1.637 . . . . 0.0 110.135 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 31' ' ' ALA . 4.3 mm -55.88 -58.15 5.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.584 174.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.558 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 54.7 mt-30 -73.28 -32.77 64.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.752 0.31 . . . . 0.0 110.894 -175.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -60.99 -37.3 81.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-O 120.775 0.322 . . . . 0.0 110.216 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.609 ' HA ' ' HB3' ' A' ' 41' ' ' LYS . 32.6 m -75.68 -30.18 59.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.272 175.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 5.9 mp -55.68 -47.93 75.91 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-O 120.961 0.41 . . . . 0.0 109.943 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.8 m -67.16 -37.21 83.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.542 0.687 . . . . 0.0 110.161 176.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.609 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 27.9 tptp -69.86 -10.28 57.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.069 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.806 ' HA ' ' HB2' ' A' ' 45' ' ' SER . . . -124.56 12.95 8.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.262 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.451 ' HE2' ' CE2' ' A' ' 44' ' ' TYR . 6.9 ttpm? -46.21 -41.89 13.42 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.993 0.808 . . . . 0.0 111.467 -173.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.451 ' CE2' ' HE2' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -136.92 -1.61 2.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.136 0.494 . . . . 0.0 110.078 168.532 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.806 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 20.6 m -64.09 -68.15 0.37 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.937 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.969 ' HD1' ' HB2' ' A' ' 15' ' ' SER . 97.6 m-85 -86.24 13.27 8.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.8 p 45.26 57.29 4.91 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.027 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.518 HD13 ' HA ' ' A' ' 39' ' ' LEU . 7.2 tt -78.96 9.2 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.764 -175.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.703 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.3 mp -56.39 -23.27 36.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.636 -175.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.6 m -65.53 -34.33 78.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.193 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -128.81 90.62 45.47 Favored Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 120.956 0.408 . . . . 0.0 111.003 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -84.56 7.44 5.18 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.653 2.235 . . . . 0.0 111.977 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.464 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 32.8 m-20 -112.55 146.53 35.17 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.135 -176.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 26.4 Cg_endo -94.18 1.65 3.01 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.619 2.879 . . . . 0.0 112.283 -177.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.418 ' O ' ' HD2' ' A' ' 106' ' ' LYS . 2.6 p -77.64 -16.98 58.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.959 -173.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.14 3.96 39.05 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.849 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.539 ' HB3' HD12 ' A' ' 35' ' ' ILE . 20.8 m-85 -118.54 134.45 55.08 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.259 0.552 . . . . 0.0 112.149 -171.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.87 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -108.69 178.8 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.445 163.158 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 1.108 HD11 ' HB3' ' A' ' 101' ' ' PHE . 3.0 tm? -131.04 132.84 45.21 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -98.83 125.97 44.35 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.546 -175.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.0 pt-20 -88.74 86.0 6.89 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.36 1.076 . . . . 0.0 108.508 170.077 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.607 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 17.9 tt0 -85.53 122.66 29.98 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.525 -0.735 . . . . 0.0 109.145 175.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.566 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.3 OUTLIER -115.61 117.92 57.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 121.449 0.642 . . . . 0.0 110.08 176.194 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.554 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 59.3 t -83.84 103.92 11.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.016 -175.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -92.7 88.12 6.15 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.503 174.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -66.37 149.34 50.54 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.494 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -114.32 139.86 49.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.134 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.4 m -76.63 -32.08 57.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.17 -178.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -100.72 -96.47 0.26 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.06 110.93 22.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.06 0.457 . . . . 0.0 112.065 -168.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.618 ' HD2' ' H ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -117.55 162.47 17.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.731 175.934 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.12 -46.72 40.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.314 0.578 . . . . 0.0 110.667 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.0 t -167.44 -35.15 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.991 175.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.01 164.8 40.54 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.89 176.012 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -53.01 145.51 41.21 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.694 2.263 . . . . 0.0 112.354 174.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 76' ' ' LYS . 57.3 mmtt -81.24 128.87 34.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.587 -176.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 6.8 p -109.05 107.4 17.72 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.485 -179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.1 m -82.16 104.93 12.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.489 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.572 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 18.5 tt0 -94.34 131.21 40.21 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -176.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.521 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 29.4 ttt180 -126.68 149.85 49.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.548 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -105.8 139.5 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.822 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.685 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 23.6 mt -96.86 156.89 16.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.306 0.574 . . . . 0.0 111.578 -176.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.525 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 47.2 mt -76.98 168.45 20.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 162.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.16 -40.13 64.08 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -120.73 35.69 4.8 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.695 0.283 . . . . 0.0 111.669 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.685 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 23.9 tp10 -65.57 -17.68 64.76 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.022 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.572 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 18.9 m 78.2 109.48 0.07 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.521 176.045 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.496 HG23 ' C ' ' A' ' 30' ' ' THR . 86.8 t -55.71 -45.84 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.332 173.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -73.72 -35.54 65.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.66 -175.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.572 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 57.5 mt-30 -62.31 -45.37 93.56 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 173.19 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.24 90.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.677 177.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -54.41 -47.35 72.86 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.81 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.7 t -75.29 -4.44 39.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 0.0 110.466 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -99.35 -6.69 27.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.963 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.508 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -72.59 161.12 31.19 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.724 0.773 . . . . 0.0 112.541 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -128.77 21.59 5.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.02 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -178.0 169.59 41.5 Favored Glycine 0 N--CA 1.44 -1.078 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.248 -178.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.466 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -88.58 102.96 15.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 117.347 0.574 . . . . 0.0 111.376 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.607 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -111.09 -149.18 11.57 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.422 -0.894 . . . . 0.0 111.898 177.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.4 mptp? -152.61 155.01 36.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 1.108 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.4 m-85 -86.91 116.73 25.17 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 173.17 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.595 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -101.46 122.91 54.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 O-C-N 122.013 -0.429 . . . . 0.0 110.365 -173.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.506 ' CD1' HD13 ' A' ' 35' ' ' ILE . 7.5 tp -74.2 135.52 42.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.84 ' HD2' HG23 ' A' ' 109' ' ' VAL . 22.6 ttmm -160.81 149.39 16.41 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.624 -179.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.533 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 10.9 mp -70.39 141.68 52.15 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.204 174.092 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.87 ' HB3' HG13 ' A' ' 58' ' ' VAL . 14.3 ptpt -72.64 -31.04 64.81 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.907 -179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -72.83 -17.07 61.59 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 177.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -108.28 5.84 26.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.633 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.84 HG23 ' HD2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -108.4 -12.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.606 -178.508 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -60.81 83.44 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 122.028 0.918 . . . . 0.0 112.467 -168.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -101.14 -4.98 26.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.053 177.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.3 t -119.7 120.82 37.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.068 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 51.9 ttm-85 58.77 71.35 0.59 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.554 0.692 . . . . 0.0 110.665 -176.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' ' 114' ' ' GLU . 0.4 OUTLIER -100.02 -0.03 40.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.546 176.423 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -77.32 82.18 3.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.793 178.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--N 1.324 -0.514 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.092 -175.776 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.477 0.892 0 CA-C-O 121.177 0.513 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.407 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 32.4 m -128.63 125.19 37.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.584 -175.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.8 -21.69 43.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.486 0.66 . . . . 0.0 109.563 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.407 ' O ' ' HB3' ' A' ' 2' ' ' SER . 16.2 pt-20 -137.22 172.47 12.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.933 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.66 109.03 20.57 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 171.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -144.56 160.74 40.64 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.677 -177.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.531 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 6.0 p90 -147.87 155.46 41.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.5 ' CZ ' ' HD2' ' A' ' 24' ' ' LYS . 65.7 m-85 -87.08 129.61 34.84 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.188 -175.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.583 ' HB ' HG13 ' A' ' 23' ' ' ILE . 22.1 t -109.09 131.34 60.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.087 0.47 . . . . 0.0 110.767 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HG2' ' HG2' ' A' ' 100' ' ' LYS . 34.6 tt0 -101.57 106.49 17.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 166.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.626 ' HB ' ' HB2' ' A' ' 101' ' ' PHE . 1.8 p -139.57 137.89 39.82 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-O 120.883 0.373 . . . . 0.0 111.337 -172.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.596 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 94.0 m-70 -95.39 150.39 20.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 177.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.512 ' O ' ' HB ' ' A' ' 14' ' ' VAL . 8.5 p-10 -97.42 -70.39 0.72 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.512 ' HB ' ' O ' ' A' ' 13' ' ' ASP . 9.3 p 171.42 -23.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.319 0 C-N-CA 122.996 0.518 . . . . 0.0 110.564 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.1 m -75.84 156.76 84.37 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.672 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -89.5 -159.79 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 123.162 2.575 . . . . 0.0 112.02 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 66.29 -75.24 0.06 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.237 0.615 . . . . 0.0 110.712 -176.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.468 ' HB2' ' OH ' ' A' ' 46' ' ' TYR . 15.8 mm100 -114.56 82.3 7.72 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 170.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -76.5 -10.19 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.289 2.659 . . . . 0.0 113.332 -169.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp -110.33 126.23 54.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.975 0.417 . . . . 0.0 110.996 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 87.8 m -98.24 121.15 39.82 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.05 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.1 t -110.82 111.33 35.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 0.0 109.846 176.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.583 HG13 ' HB ' ' A' ' 9' ' ' VAL . 2.5 pt -124.12 159.83 29.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.298 -178.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HD2' ' CZ ' ' A' ' 8' ' ' PHE . 1.4 ttpm? -109.95 96.55 6.31 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 171.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.69 163.67 18.03 Favored Pre-proline 0 CA--C 1.504 -0.82 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.929 -175.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.984 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.3 Cg_exo -68.42 145.91 66.69 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.704 1.603 . . . . 0.0 110.974 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.531 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 73.6 mtt180 -62.02 -15.69 46.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.781 0.801 . . . . 0.0 109.634 -178.165 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.3 m -98.13 -4.59 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.3 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.984 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.7 p -55.72 123.25 13.52 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.786 0.803 . . . . 0.0 110.476 178.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.546 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 1.0 OUTLIER -103.53 174.61 5.79 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.991 173.246 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.15 -51.19 18.85 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 123.522 0.514 . . . . 0.0 111.331 -173.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.404 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 6.1 tp-100 -60.92 -31.6 71.12 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.463 -178.5 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -78.76 -51.86 9.19 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 -177.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.447 HG11 HG21 ' A' ' 88' ' ' VAL . 2.9 p -60.55 -28.54 42.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.765 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.655 HD13 ' HG ' ' A' ' 103' ' ' LEU . 5.8 mm -56.45 -57.86 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.052 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.524 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 28.4 tt0 -70.76 -32.37 69.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.201 -174.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.402 HE22 ' HD3' ' A' ' 26' ' ' PRO . 28.1 tt0 -60.87 -38.01 84.11 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.978 0.418 . . . . 0.0 110.251 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.5 m -71.01 -31.92 68.56 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.078 175.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -62.42 -33.7 75.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.409 0.623 . . . . 0.0 110.806 173.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t -78.24 -36.74 46.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.812 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -70.98 -50.33 35.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.216 0.531 . . . . 0.0 110.179 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.785 ' HA ' ' HB2' ' A' ' 45' ' ' SER . . . -113.88 80.78 1.43 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.023 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.724 ' O ' HD12 ' A' ' 49' ' ' LEU . 37.4 ttmt -87.64 -80.8 0.25 Allowed 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 171.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.87 -18.07 48.54 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.192 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.785 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 42.5 m -62.0 113.8 3.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.316 171.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.468 ' OH ' ' HB2' ' A' ' 18' ' ' GLN . 29.1 m-85 64.98 2.93 1.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.647 0.592 . . . . 0.0 110.823 -175.479 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.1 t 48.9 75.13 0.15 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.913 0.863 . . . . 0.0 111.639 -174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.639 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 41.6 mm -97.59 -9.18 9.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.054 -0.975 . . . . 0.0 109.16 175.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.724 HD12 ' O ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.99 10.15 1.6 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.822 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 p -55.19 -37.36 66.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-O 121.609 0.718 . . . . 0.0 109.113 172.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.467 ' HB2' ' HE1' ' A' ' 57' ' ' TYR . 17.2 m120 -120.62 90.56 46.12 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.351 167.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -73.25 -11.75 25.08 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.608 2.205 . . . . 0.0 112.598 -172.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.21 125.03 39.28 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-O 121.328 0.585 . . . . 0.0 109.915 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -76.7 -3.23 13.55 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.832 2.354 . . . . 0.0 112.831 -173.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.571 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 14.8 m -76.95 0.32 21.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.701 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 8.1 m-20 -108.11 0.49 21.67 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.025 0.441 . . . . 0.0 110.275 174.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.596 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 47.0 m-85 -107.62 156.52 18.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.093 -177.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.669 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.38 169.21 21.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 167.419 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 1.07 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -123.0 139.62 53.89 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -174.725 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.641 HD13 HG13 ' A' ' 81' ' ' VAL . 1.0 OUTLIER -103.11 128.63 49.96 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.017 -177.207 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.7 ' HG3' ' HB3' ' A' ' 80' ' ' ARG . 9.4 pt-20 -92.94 87.3 5.73 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.037 0.922 . . . . 0.0 108.96 171.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 9.7 tt0 -85.7 123.3 30.93 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.026 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.573 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.37 116.66 52.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.589 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t -76.86 98.42 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.309 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.511 ' HD3' ' HD3' ' A' ' 96' ' ' LYS . 10.2 mtmp? -82.41 82.09 8.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 172.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.556 ' HB2' ' HB3' ' A' ' 75' ' ' PRO . 3.2 p30 -71.16 179.95 2.61 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.987 -1.006 . . . . 0.0 112.37 -169.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 m -133.38 92.27 2.98 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 113.923 -1.49 . . . . 0.0 109.715 -174.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 40.1 m -72.79 93.83 1.72 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.889 178.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.475 HD22 ' N ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -148.33 178.08 8.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.787 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -123.47 61.48 1.05 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.148 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 71' ' ' LYS . 26.2 mmtp -137.64 -175.29 4.02 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.945 172.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.1 m -77.54 -11.65 59.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.992 0.425 . . . . 0.0 110.706 -179.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.64 114.74 4.61 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.939 176.229 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.8 p -89.37 163.21 34.54 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.708 -175.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.556 ' HB3' ' HB2' ' A' ' 66' ' ' ASP . 25.2 Cg_exo -63.57 159.75 39.3 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.909 2.406 . . . . 0.0 111.811 174.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.73 128.67 47.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.233 0.54 . . . . 0.0 112.025 -171.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 19.8 m -93.4 115.26 27.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.442 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 m -92.97 103.9 16.18 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.2 tt0 -94.85 131.29 40.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.892 0.377 . . . . 0.0 110.217 -174.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.7 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 38.8 ttm180 -127.2 158.12 37.96 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.668 HG11 HG11 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -112.62 144.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 118.355 0.525 . . . . 0.0 110.819 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 19.8 mt -100.01 -177.07 3.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.31 0.576 . . . . 0.0 111.524 -176.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.794 ' H ' ' HB3' ' A' ' 86' ' ' GLU . 17.1 mt -117.62 -170.83 1.94 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.962 -179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.44 -30.66 71.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.164 0.507 . . . . 0.0 109.874 175.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.69 19.78 5.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -177.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.794 ' HB3' ' H ' ' A' ' 83' ' ' LEU . 13.7 tp10 -79.27 80.82 5.6 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 123.085 1.421 . . . . 0.0 107.771 169.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 58.1 m -35.63 135.45 0.28 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-N 110.257 -3.156 . . . . 0.0 113.68 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.535 ' H ' ' HA ' ' A' ' 30' ' ' THR . 55.3 t -76.16 -41.47 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.468 -175.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -72.44 -33.99 67.46 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.657 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 1.6 mt-30 -64.37 -42.19 96.3 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.299 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.549 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -63.19 -45.75 90.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.681 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -59.63 -29.72 68.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.693 -178.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.1 p -76.95 -20.69 55.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.343 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.549 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 75.1 mttt -73.02 -30.0 63.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.37 0.605 . . . . 0.0 110.209 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.485 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -49.09 128.84 17.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.872 -167.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.542 ' H ' HG21 ' A' ' 63' ' ' VAL . 22.4 mtpp -97.21 20.11 11.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.043 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 179.16 -171.56 43.55 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.595 -177.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -103.14 111.25 23.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.772 0.786 . . . . 0.0 110.768 178.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.573 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -116.45 -149.28 9.2 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.12 -177.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.688 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 2.0 mtmt -151.11 145.53 25.53 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 1.07 ' HB3' HD11 ' A' ' 59' ' ' LEU . 98.0 m-85 -79.2 154.22 29.41 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 67.3 mt -142.93 129.62 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 O-C-N 121.679 -0.638 . . . . 0.0 111.65 -174.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.655 ' HG ' HD13 ' A' ' 35' ' ' ILE . 5.8 mp -73.36 141.54 47.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.902 0.382 . . . . 0.0 110.98 176.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.487 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 9.3 tppt? -154.06 176.29 12.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.409 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.596 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.0 mp -101.28 142.57 32.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.164 0.507 . . . . 0.0 110.05 174.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.669 ' HB3' HG13 ' A' ' 58' ' ' VAL . 16.9 ptmt -82.07 -21.7 36.72 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.008 -177.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -70.3 -23.76 62.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.836 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 4.0 pt20 -101.35 -26.99 13.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.077 0.465 . . . . 0.0 109.857 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.668 HG11 HG11 ' A' ' 81' ' ' VAL . 6.8 t -75.8 -51.21 21.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.258 176.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.619 ' OE1' ' HA ' ' A' ' 115' ' ' ASP . 4.1 pt20 40.61 31.1 0.1 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 174.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.477 ' H ' HG12 ' A' ' 109' ' ' VAL . . . 58.13 18.43 5.27 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 177.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -133.47 168.93 17.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.959 0.409 . . . . 0.0 110.325 -178.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -94.56 -5.21 46.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -141.3 -179.61 6.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.876 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.619 ' HA ' ' OE1' ' A' ' 110' ' ' GLN . 2.8 p-10 -88.97 -25.33 22.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.756 0.312 . . . . 0.0 110.947 -178.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.5 tptt . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.608 -177.773 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.506 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HB3' HD11 ' A' ' 20' ' ' LEU . 45.8 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.797 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.548 ' HB2' HG13 ' A' ' 102' ' ' ILE . 78.2 m-70 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.58 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.862 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.675 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.535 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.832 HD13 ' HB2' ' A' ' 57' ' ' TYR . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.518 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 37.2 m-20 . . . . . 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' ' 35' ' ' ILE . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.598 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 1.044 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.735 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.648 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.543 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.862 0.363 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.611 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.51 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.546 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.411 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.657 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.641 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.57 ' H ' ' HA ' ' A' ' 30' ' ' THR . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 0.9 OUTLIER -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.496 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.482 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.648 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 1.044 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.735 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.598 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmm? . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 121.279 0.562 . . . . 0.0 109.76 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.772 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 12.5 p90 -113.8 154.77 26.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.061 -175.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -87.2 129.81 34.81 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 111.333 -176.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.584 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.5 t -115.73 127.82 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.348 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.584 ' HB3' HD11 ' A' ' 20' ' ' LEU . 34.6 mt-30 -102.05 107.09 18.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.783 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.6 OUTLIER -130.22 130.67 65.77 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.709 -174.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 . . . . . 0 C--N 1.316 -0.851 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.466 -175.969 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.584 HD11 ' HB3' ' A' ' 10' ' ' GLN . 56.4 tp . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.625 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 29.7 m -82.09 109.44 16.41 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.341 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.12 111.22 24.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.923 0.392 . . . . 0.0 109.979 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.584 HG13 ' HB ' ' A' ' 9' ' ' VAL . 17.7 pt -122.36 173.25 8.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.778 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -122.03 97.61 5.56 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.22 160.28 30.16 Favored Pre-proline 0 CA--C 1.504 -0.795 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.755 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.856 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.8 Cg_exo -66.01 141.83 65.81 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 121.848 1.699 . . . . 0.0 111.386 -177.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.772 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 38.0 mtp180 -63.69 -0.57 1.03 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.609 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.435 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.6 m -114.35 -9.96 12.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.642 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.856 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.6 p -53.86 133.45 42.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 110.935 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 21.4 p -96.81 -169.99 1.97 Allowed 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.572 ' HA ' HG13 ' A' ' 88' ' ' VAL . . . -59.03 -48.55 81.19 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.248 178.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.45 -32.59 67.09 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 123.15 0.281 . . . . 0.0 111.398 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -74.44 -53.74 8.96 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 122.245 1.022 . . . . 0.0 109.94 -176.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 88' ' ' VAL . 5.1 p -65.95 -27.47 41.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.126 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.823 HD13 HD12 ' A' ' 103' ' ' LEU . 3.1 mm -56.07 -58.22 5.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.141 171.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 28.2 tt0 -72.45 -32.33 66.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.293 -175.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -59.47 -35.26 73.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 122.106 -0.371 . . . . 0.0 110.683 176.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.9 m -68.89 -41.09 78.75 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 9.7 mp -54.13 -40.88 67.8 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.653 172.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.8 t -67.81 -33.31 74.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.468 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -73.18 -32.73 65.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.397 0.618 . . . . 0.0 109.972 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.423 177.774 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 CA--C 1.516 -0.35 0 CA-C-O 120.985 0.421 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 29.9 m-85 -109.89 150.15 28.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.183 0.516 . . . . 0.0 111.098 -177.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -126.06 160.33 33.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.675 168.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 1.028 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.2 tm? -116.78 135.03 54.07 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.866 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.8 OUTLIER -98.41 130.71 45.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.09 -176.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.663 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.8 pt-20 -96.93 91.11 5.46 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.435 1.112 . . . . 0.0 108.52 169.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.658 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 3.3 tt0 -88.21 123.03 32.43 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 121.227 -0.921 . . . . 0.0 109.705 172.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.507 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -112.45 117.46 55.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.316 0.579 . . . . 0.0 109.564 169.836 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.67 HG23 ' HA2' ' A' ' 99' ' ' GLY . 51.8 t . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.21 -176.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.827 0.346 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.422 ' HB2' HG13 ' A' ' 63' ' ' VAL . 17.9 m -83.86 96.94 8.94 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 176.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.0 tt0 -97.79 131.7 44.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.879 -0.601 . . . . 0.0 109.993 -175.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.573 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 24.5 ttt180 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.69 HG13 HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -110.35 140.55 28.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.482 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.5 mt -100.89 150.11 23.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.215 0.531 . . . . 0.0 111.653 -174.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.36 156.36 38.45 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 162.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.16 -32.99 38.37 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.811 0.338 . . . . 0.0 111.738 -175.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -110.38 19.64 18.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.8 -9.56 45.38 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.835 178.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 85.4 m 68.44 106.73 0.05 Allowed 'General case' 0 C--O 1.219 -0.537 0 O-C-N 123.931 0.769 . . . . 0.0 111.471 175.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 34' ' ' VAL . 17.0 m -72.34 -32.08 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.159 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -73.47 -37.19 65.86 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 118.881 -1.128 . . . . 0.0 109.042 178.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.637 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 57.4 mt-30 -62.0 -45.74 92.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.84 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.8 -44.03 81.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.74 -37.58 76.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.049 -178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 65.1 p -76.28 -11.99 60.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.835 0.35 . . . . 0.0 111.318 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 86.5 mttt -82.91 -21.8 34.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.228 0.537 . . . . 0.0 109.705 177.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.443 ' CG ' ' HB ' ' A' ' 63' ' ' VAL . 43.4 m0 -64.34 157.77 25.33 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.719 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.422 ' H ' HG21 ' A' ' 63' ' ' VAL . 62.2 mttm -137.7 19.23 2.87 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.174 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -160.6 165.61 35.11 Favored Glycine 0 N--CA 1.441 -0.978 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -86.76 104.76 16.45 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 117.99 0.895 . . . . 0.0 110.816 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.67 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -107.76 -147.61 13.47 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.147 -1.025 . . . . 0.0 112.147 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -150.43 153.93 36.81 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 176.136 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 1.028 ' HB3' HD11 ' A' ' 59' ' ' LEU . 96.8 m-85 -87.0 154.74 20.54 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 166.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.866 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 4.9 mp -135.18 127.18 47.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 121.66 -0.65 . . . . 0.0 110.951 -178.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.823 HD12 HD13 ' A' ' 35' ' ' ILE . 7.6 tp -83.14 127.53 33.68 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.464 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 5.6 tppt? -149.11 175.82 11.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.573 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.1 mp -98.17 144.17 27.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 0.0 110.491 172.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.725 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmt . . . . . 0 C--N 1.316 -0.867 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.166 -176.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.406 ' OG ' ' HE2' ' A' ' 24' ' ' LYS . 57.1 p . . . . . 0 N--CA 1.445 -0.704 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.626 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 6.9 p90 -148.66 153.5 38.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -90.9 128.25 36.69 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.505 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.575 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.6 t -108.97 125.66 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.254 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.606 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 84.1 mt-30 -93.61 107.38 19.24 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.794 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -124.14 115.69 45.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.429 0.633 . . . . 0.0 110.576 -178.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.584 ' HB2' HG13 ' A' ' 102' ' ' ILE . 45.0 m-70 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.601 -175.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.561 HD11 ' HB3' ' A' ' 10' ' ' GLN . 52.7 tp . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.526 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 34.1 m -71.43 108.95 5.1 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.202 -176.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.4 t -96.14 111.06 25.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.4 pt -118.8 176.51 3.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.701 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.406 ' HE2' ' OG ' ' A' ' 6' ' ' SER . 51.4 tttt -124.9 97.75 5.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -98.86 170.98 6.22 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.138 -176.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.873 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.8 Cg_endo -75.64 140.8 24.14 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 C-N-CA 122.165 1.91 . . . . 0.0 110.14 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.626 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 90.7 mtt180 -54.24 -42.92 70.43 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 m -68.63 -10.37 13.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.951 178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.873 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 85.9 p -57.02 128.77 38.66 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.422 0.63 . . . . 0.0 110.783 177.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.514 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -102.3 179.19 4.38 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 171.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.787 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.42 -50.3 31.61 Favored 'General case' 0 C--O 1.213 -0.865 0 O-C-N 123.297 0.373 . . . . 0.0 111.013 -174.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.48 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -56.35 -35.45 67.65 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.96 -52.97 11.15 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.935 0.874 . . . . 0.0 110.021 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 59' ' ' LEU . 5.3 p -63.13 -27.44 43.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.89 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.787 HG12 ' O ' ' A' ' 31' ' ' ALA . 3.5 mm -55.75 -58.26 5.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.128 173.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.488 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 6.3 tp-100 -69.39 -33.63 73.31 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.024 -177.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.435 HE22 ' HA ' ' A' ' 25' ' ' ALA . 17.6 tt0 -65.52 -36.67 84.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.48 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.2 m -70.52 -35.62 73.27 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.552 HD13 ' O ' ' A' ' 35' ' ' ILE . 6.9 mp -54.44 -46.21 73.22 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.443 171.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.06 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -79.95 -23.3 41.79 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.777 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.44 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -172.536 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 15.5 m-20 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 120.769 0.318 . . . . 0.0 111.446 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.619 ' HB3' HD12 ' A' ' 35' ' ' ILE . 50.0 m-85 -103.69 152.94 21.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.482 0.658 . . . . 0.0 111.425 -175.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -136.03 161.89 37.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 168.621 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 34' ' ' VAL . 21.1 tp -115.29 148.39 39.26 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.484 -0.487 . . . . 0.0 109.98 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.3 mm? -106.44 134.56 49.39 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.796 ' HB3' HD21 ' A' ' 82' ' ' LEU . 12.6 pt-20 -98.87 87.34 3.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 122.378 1.085 . . . . 0.0 108.665 170.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.615 ' HB2' ' HG3' ' A' ' 79' ' ' GLN . 0.4 OUTLIER -87.07 124.47 33.26 Favored 'General case' 0 N--CA 1.414 -2.255 0 O-C-N 121.656 -0.652 . . . . 0.0 109.757 174.73 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.595 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.6 OUTLIER -113.86 111.25 35.21 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.422 174.054 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 92.5 t . . . . . 0 CA--C 1.512 -0.517 0 CA-C-O 121.389 0.614 . . . . 0.0 110.046 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.6 p . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 121.029 0.443 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.517 ' HB3' HG13 ' A' ' 63' ' ' VAL . 11.9 t -87.6 99.28 11.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.615 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 6.9 tt0 -94.93 131.69 40.58 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.273 -0.422 . . . . 0.0 109.927 -175.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.657 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 27.1 ttt180 -126.72 157.57 38.74 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.563 HG13 HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -111.99 144.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 118.482 0.583 . . . . 0.0 110.104 177.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.963 HD22 ' HG2' ' A' ' 86' ' ' GLU . 16.5 mt -103.17 154.64 19.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.237 0.541 . . . . 0.0 111.575 -173.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.7 mp -87.24 176.0 7.77 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.758 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -47.27 -51.31 19.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.463 0.477 . . . . 0.0 111.475 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -115.03 41.64 2.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.963 ' HG2' HD22 ' A' ' 82' ' ' LEU . 14.1 tp10 -62.34 -28.46 69.77 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.64 ' HB2' HE21 ' A' ' 90' ' ' GLN . 22.9 m 73.21 122.04 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.482 -175.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.503 ' H ' ' HA ' ' A' ' 30' ' ' THR . 94.0 t -74.68 -36.97 42.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.024 -173.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' A' ' 27' ' ' ARG . 86.7 t80 -73.39 -34.3 65.46 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.64 HE21 ' HB2' ' A' ' 87' ' ' CYS . 13.8 mt-30 -64.92 -44.73 88.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.87 175.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.479 ' HA ' ' NZ ' ' A' ' 94' ' ' LYS . . . -62.9 -46.69 86.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.039 0.447 . . . . 0.0 110.452 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -56.16 -38.8 71.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.372 -178.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.7 p -74.3 -5.01 39.64 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.479 ' NZ ' ' HA ' ' A' ' 91' ' ' ALA . 10.8 mttp -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.2 0.524 . . . . 0.0 110.643 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.429 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 44.6 m0 -64.41 155.36 32.77 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.871 -173.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.47 ' H ' HG21 ' A' ' 63' ' ' VAL . 98.8 mttt -130.8 18.34 5.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.13 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -163.7 166.79 37.53 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 109.278 -1.529 . . . . 0.0 109.278 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.31 93.27 8.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 118.018 0.909 . . . . 0.0 111.088 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.605 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -100.98 -150.23 23.97 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.206 -0.997 . . . . 0.0 112.024 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.606 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -151.89 155.56 38.35 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 175.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.794 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.5 m-85 -86.52 124.48 32.88 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -102.17 122.09 54.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.801 -0.562 . . . . 0.0 110.397 -174.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.9 tp -75.29 135.49 40.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.5 ttmm -156.86 176.6 12.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.586 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 6.6 mp -104.19 143.98 32.21 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.49 ' N ' HG22 ' A' ' 58' ' ' VAL . 12.1 ptmm? . . . . . 0 C--N 1.309 -1.165 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.186 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.452 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 54.3 p . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 120.9 0.381 . . . . 0.0 110.109 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.936 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.4 p90 -116.51 152.49 33.97 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.426 ' CE2' ' HD3' ' A' ' 24' ' ' LYS . 69.4 m-85 -89.42 131.8 35.3 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.445 -175.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.517 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.8 t -122.33 155.85 27.25 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 176.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.405 ' HB2' HD11 ' A' ' 20' ' ' LEU . 5.1 pm0 -129.46 107.3 9.38 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 163.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -115.04 140.07 38.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.477 -176.77 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 . . . . . 0 C--N 1.314 -0.975 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.863 -179.457 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 10' ' ' GLN . 58.9 tp . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.362 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.5 HG22 HG23 ' A' ' 23' ' ' ILE . 20.7 m -112.1 107.94 17.05 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.506 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.3 t -86.43 111.06 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.5 HG23 HG22 ' A' ' 21' ' ' THR . 9.9 pt -125.34 119.09 54.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.957 0.408 . . . . 0.0 111.779 -176.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HD3' ' CE2' ' A' ' 8' ' ' PHE . 21.3 ttpp -79.8 118.51 21.65 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.59 161.84 56.67 Favored Pre-proline 0 C--N 1.318 -0.801 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.665 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 7.5 Cg_exo -62.75 142.51 89.35 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 121.915 1.743 . . . . 0.0 111.907 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.936 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 46.4 mtp180 -63.51 -1.2 1.11 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.49 0.662 . . . . 0.0 110.015 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.4 m -107.9 -11.71 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.204 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.665 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 2.9 m -54.69 124.04 15.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.729 0.776 . . . . 0.0 112.826 176.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.627 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -98.33 177.47 5.36 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.545 171.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.35 -51.43 26.27 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.44 0.462 . . . . 0.0 111.362 -172.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.425 ' CA ' HE21 ' A' ' 32' ' ' GLN . 0.0 OUTLIER -64.82 -31.59 72.89 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.081 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -42.95 43.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 110.152 -176.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.52 ' CG1' HG21 ' A' ' 88' ' ' VAL . 1.3 p -72.5 -29.2 30.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.696 176.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.566 HD12 ' HB3' ' A' ' 57' ' ' TYR . 5.9 mm -56.51 -57.33 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 171.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.497 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 26.7 tt0 -64.5 -31.43 72.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.934 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 34' ' ' VAL . 6.2 tp60 -63.44 -40.79 98.09 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.145 0.498 . . . . 0.0 109.765 175.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 m -67.92 -32.09 72.3 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.693 175.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.8 mp -61.61 -33.75 74.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.189 0.519 . . . . 0.0 110.727 173.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.6 m -68.9 -39.4 79.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.063 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.488 ' HG3' HG22 ' A' ' 23' ' ' ILE . 74.5 mmtt -78.74 -49.81 12.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.876 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.53 0 CA-C-O 121.716 0.769 . . . . 0.0 109.657 176.251 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.695 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.017 0.437 . . . . 0.0 111.085 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.566 ' HB3' HD12 ' A' ' 35' ' ' ILE . 15.9 m-85 -106.31 130.53 54.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.181 -175.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.544 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -113.08 165.57 7.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 168.017 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 101' ' ' PHE . 17.6 tp -118.56 138.38 52.59 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.608 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.4 mm? -98.72 126.55 44.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.792 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.682 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.6 pt-20 -88.81 84.35 6.67 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.621 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 12.7 tt0 -85.77 123.37 31.08 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 119.477 -0.889 . . . . 0.0 108.798 175.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.608 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.01 108.82 25.9 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.738 0.78 . . . . 0.0 110.327 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 78.9 t . . . . . 0 C--N 1.322 -0.594 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.558 -173.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.7 p . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -109.62 100.67 9.68 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.56 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.8 tt0 -95.05 131.27 41.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -134.35 129.89 36.13 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.576 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -85.86 136.47 22.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.269 -173.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.559 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 22.3 mt -93.63 151.8 19.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.501 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.482 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 7.1 mp -80.2 167.03 20.83 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 163.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -54.63 -31.86 57.99 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.495 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 2.3 pt20 -122.13 39.84 3.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.559 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 8.1 mm-40 -76.92 -7.51 55.69 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.262 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.706 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 12.7 t 70.21 130.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 0.0 111.333 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.627 ' H ' ' HA ' ' A' ' 30' ' ' THR . 93.8 t -78.58 -46.89 24.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 CA-C-O 121.344 0.592 . . . . 0.0 109.768 178.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -72.55 -41.37 65.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.557 -175.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.706 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 8.2 mm-40 -63.65 -43.61 96.25 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.345 175.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.88 -49.3 77.18 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.866 0.365 . . . . 0.0 110.436 175.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -57.64 -35.39 70.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.291 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -78.42 -5.96 53.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.012 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.706 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 73.1 mmtt -95.5 -12.64 25.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.227 0.536 . . . . 0.0 110.368 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.454 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 27.2 m0 -57.28 140.21 50.62 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -169.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.608 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.7 mppt? -102.23 38.9 1.58 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.766 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 155.12 -175.5 33.09 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.93 -177.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.557 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.43 108.76 21.31 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.985 0.392 . . . . 0.0 110.168 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -113.46 -150.32 10.54 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.425 -177.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.453 ' HB2' ' HE2' ' A' ' 100' ' ' LYS . 27.8 mtmm -150.25 139.29 21.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.635 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 97.9 m-85 -83.23 146.49 28.55 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.753 -0.779 . . . . 0.0 108.971 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.608 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 80.1 mt -136.23 127.23 42.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 O-C-N 122.182 -0.324 . . . . 0.0 111.376 -172.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.522 ' HG ' HD13 ' A' ' 35' ' ' ILE . 4.7 mp -79.28 109.8 13.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.16 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 58' ' ' VAL . 33.6 ttpt -139.67 136.93 34.78 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 176.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.56 HD21 ' CE1' ' A' ' 57' ' ' TYR . 18.5 mt -69.17 142.64 54.26 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.461 0.648 . . . . 0.0 112.507 -171.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.4 ptmm? . . . . . 0 C--N 1.314 -0.953 0 CA-C-N 114.427 -1.261 . . . . 0.0 110.084 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m . . . . . 0 N--CA 1.447 -0.612 0 CA-C-O 121.664 0.745 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.863 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 16.5 p90 -115.78 149.84 37.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.598 -1.183 . . . . 0.0 107.896 176.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -82.73 119.8 24.78 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.563 -173.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.609 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.7 t -108.72 130.98 60.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.652 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.456 ' HG2' HG22 ' A' ' 22' ' ' VAL . 45.9 mt-30 -104.15 109.01 20.65 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 164.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.637 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.5 p -129.23 121.65 54.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.066 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.613 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 91.1 m-70 . . . . . 0 C--N 1.318 -0.767 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.039 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.577 ' HA ' ' HA ' ' A' ' 12' ' ' HIS . 64.6 tp . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 120.738 0.304 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.5 m -94.81 124.89 39.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.528 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.456 HG22 ' HG2' ' A' ' 10' ' ' GLN . 46.8 t -102.86 112.92 38.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 171.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.609 HG13 ' HB ' ' A' ' 9' ' ' VAL . 3.1 pt -128.3 168.25 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.132 0.492 . . . . 0.0 111.626 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -117.85 96.98 5.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.732 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -100.69 157.65 33.33 Favored Pre-proline 0 CA--C 1.499 -0.998 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.736 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.9 Cg_exo -63.7 140.48 74.67 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 121.587 1.525 . . . . 0.0 111.436 -174.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.863 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 59.4 mtp180 -62.88 -0.74 0.72 Allowed 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 121.296 0.569 . . . . 0.0 110.421 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' A' ' 26' ' ' PRO . 32.9 m -114.57 -7.16 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.763 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.736 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -59.48 135.07 57.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.124 0.487 . . . . 0.0 110.707 177.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 9.7 p -99.62 -168.29 1.58 Allowed 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.453 ' HA ' ' CG1' ' A' ' 88' ' ' VAL . . . -60.54 -50.28 74.19 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.922 -176.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.653 ' HG2' ' HB2' ' A' ' 84' ' ' ASP . 0.1 OUTLIER -59.03 -30.97 68.42 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.736 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -73.75 -52.89 11.68 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.931 0.872 . . . . 0.0 109.824 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.427 HG11 HG11 ' A' ' 88' ' ' VAL . 6.8 p -66.11 -28.14 42.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.679 -1.6 . . . . 0.0 110.3 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.499 HD13 ' HG ' ' A' ' 103' ' ' LEU . 2.3 mm -55.87 -56.21 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.389 171.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.51 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 40.9 mt-30 -64.33 -32.22 73.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.183 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.732 HE22 ' HA ' ' A' ' 25' ' ' ALA . 7.6 tt0 -61.27 -39.02 88.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.049 179.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.3 m -67.88 -38.81 83.49 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.977 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -55.56 -38.6 69.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.639 174.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.64 -45.62 89.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.133 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -70.8 -35.65 72.63 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.787 0.327 . . . . 0.0 110.942 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.683 -178.304 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 27.2 m-20 . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.282 0.563 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.565 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 42.1 m-85 -118.02 139.01 51.81 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.168 -174.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.718 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -104.99 178.9 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 162.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.582 ' HB3' HD12 ' A' ' 82' ' ' LEU . 21.0 tp -134.83 145.71 48.58 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.696 ' O ' ' HA ' ' A' ' 101' ' ' PHE . 2.6 mm? -102.05 126.92 49.11 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.622 ' HG2' ' HB3' ' A' ' 80' ' ' ARG . 11.2 pt-20 -92.32 83.75 5.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.491 1.139 . . . . 0.0 108.202 169.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.627 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -86.7 125.42 33.87 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.501 -0.75 . . . . 0.0 110.082 176.478 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.601 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.9 OUTLIER -117.54 111.33 34.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.28 0.562 . . . . 0.0 110.364 175.176 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.556 HG23 ' OE2' ' A' ' 62' ' ' GLU . 88.9 t . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.577 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.52 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 15.0 m . . . . . 0 C--O 1.235 0.331 0 CA-C-O 121.455 0.645 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -89.85 99.87 12.8 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.483 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.598 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 7.0 tt0 -94.36 131.57 39.87 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.622 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 50.2 ttt180 -127.44 149.73 49.96 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.576 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -111.86 135.07 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 118.959 0.799 . . . . 0.0 111.498 -175.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.582 HD12 ' HB3' ' A' ' 59' ' ' LEU . 35.2 mt -89.99 -161.58 0.8 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.802 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.464 ' HB3' ' OE2' ' A' ' 86' ' ' GLU . 37.0 tp -131.93 -51.68 0.97 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.839 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.653 ' HB2' ' HG2' ' A' ' 32' ' ' GLN . 17.7 p-10 177.34 -38.36 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.41 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.426 ' HG3' ' CG ' ' A' ' 84' ' ' ASP . 40.9 mt-30 -118.3 19.22 13.52 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -174.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.464 ' OE2' ' HB3' ' A' ' 83' ' ' LEU . 9.0 mp0 -62.69 -6.63 3.76 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -177.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.474 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 90.4 m 67.84 96.26 0.06 Allowed 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.531 0.52 . . . . 0.0 110.018 -176.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 31' ' ' ALA . 17.9 m -68.92 -27.21 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.282 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -71.42 -39.25 71.19 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.137 -1.025 . . . . 0.0 108.991 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 39.2 mm-40 -68.05 -43.33 78.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.576 176.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.7 79.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.455 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.9 -30.89 69.33 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.089 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.3 t -77.67 -19.67 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.514 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 31.5 mmtp -75.23 -23.86 57.61 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.956 0.407 . . . . 0.0 110.367 177.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.3 m0 -58.92 158.34 8.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -171.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.425 ' H ' HG21 ' A' ' 63' ' ' VAL . 11.6 mptt -131.03 23.13 4.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 113.815 -1.539 . . . . 0.0 109.376 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -169.04 174.29 43.54 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -93.77 98.33 11.02 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 117.458 0.629 . . . . 0.0 110.99 -177.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.645 ' O ' ' HG3' ' A' ' 100' ' ' LYS . . . -106.53 -152.54 19.46 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.784 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 10.1 mtmm -156.39 149.63 24.35 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.696 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 94.4 m-85 -82.9 151.02 26.14 Favored 'General case' 0 C--N 1.312 -1.03 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.163 169.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.521 HG13 ' HB2' ' A' ' 12' ' ' HIS . 4.4 mp -130.58 125.56 59.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 121.959 -0.463 . . . . 0.0 110.62 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.499 ' HG ' HD13 ' A' ' 35' ' ' ILE . 1.9 mp -71.05 131.2 43.28 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -154.99 170.15 22.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.3 mp -96.15 145.18 25.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.493 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.718 ' HB3' HG13 ' A' ' 58' ' ' VAL . 15.7 ptpt . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.935 0.874 . . . . 0.0 110.043 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.446 -0.626 0 CA-C-O 121.322 0.582 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.862 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.0 p90 -105.91 154.73 20.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -84.9 128.67 34.72 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.162 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.498 HG22 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -122.17 128.89 75.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.072 175.005 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.463 ' HB3' HD22 ' A' ' 20' ' ' LEU . 47.1 mt-30 -100.65 106.01 17.43 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 165.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.658 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -115.69 112.49 39.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.301 -169.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.452 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 21.5 m-70 . . . . . 0 C--N 1.32 -0.71 0 CA-C-O 121.156 0.503 . . . . 0.0 112.169 -173.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.561 HD11 ' HD3' ' A' ' 100' ' ' LYS . 5.7 mt . . . . . 0 CA--C 1.512 -0.519 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.438 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 18.8 m -93.52 108.56 20.24 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.424 175.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.5 p -92.51 119.61 40.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.438 0.637 . . . . 0.0 110.569 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 24.5 pt -128.78 144.13 39.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.345 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -98.32 95.39 7.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 170.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.63 165.17 14.21 Favored Pre-proline 0 CA--C 1.506 -0.744 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.701 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.643 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 6.1 Cg_exo -68.65 139.89 45.57 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 122.015 1.81 . . . . 0.0 112.129 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.862 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.8 mtp180 -61.76 -8.66 5.03 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.1 m -99.09 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.604 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.643 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 15.9 m -60.87 120.43 10.15 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.433 0.635 . . . . 0.0 111.5 174.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.524 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -100.0 179.07 4.61 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.35 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.624 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.2 -52.44 20.88 Favored 'General case' 0 C--O 1.216 -0.684 0 O-C-N 123.592 0.557 . . . . 0.0 111.697 -170.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.486 ' CA ' HE21 ' A' ' 32' ' ' GLN . 0.0 OUTLIER -63.86 -31.88 73.21 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -177.323 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.78 -50.34 21.05 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.8 0.81 . . . . 0.0 109.678 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.636 HG11 HD22 ' A' ' 59' ' ' LEU . 1.4 p -66.6 -27.9 41.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.442 179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 31' ' ' ALA . 5.6 mm -56.23 -57.55 8.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.078 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.554 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 41.8 tt0 -67.26 -35.1 78.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -178.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -59.47 -43.6 93.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 120.892 0.377 . . . . 0.0 110.657 175.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.3 m -71.16 -31.63 67.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.046 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 4.8 mp -55.91 -39.61 71.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.198 0.523 . . . . 0.0 110.384 171.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.3 m -72.61 -29.7 63.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.012 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -75.08 -41.1 59.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.401 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.375 0.607 . . . . 0.0 110.509 176.507 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 79.1 m-20 . . . . . 0 CA--C 1.517 -0.299 0 CA-C-O 121.305 0.574 . . . . 0.0 109.701 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.588 ' HB3' HD12 ' A' ' 35' ' ' ILE . 33.4 m-85 -108.26 154.97 21.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.753 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.72 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.25 155.6 37.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 169.439 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.636 HD22 HG11 ' A' ' 34' ' ' VAL . 22.8 tp -103.1 146.75 27.91 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.991 0.425 . . . . 0.0 110.009 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' A' ' 81' ' ' VAL . 2.1 mm? -106.81 125.45 51.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.881 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.651 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.6 pt-20 -87.76 82.67 7.29 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.3 1.048 . . . . 0.0 108.271 170.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.552 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -87.4 123.55 32.47 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 121.555 -0.716 . . . . 0.0 109.7 176.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.736 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.3 OUTLIER -119.39 118.11 56.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.107 178.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.587 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 63.3 t . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.396 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.587 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 13.4 p . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 120.912 0.387 . . . . 0.0 110.75 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.8 m -111.21 107.25 16.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.538 ' HG2' HD12 ' A' ' 60' ' ' LEU . 7.0 tt0 -93.8 131.03 39.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.88 0.371 . . . . 0.0 110.18 -172.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.519 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 55.2 ttt180 -128.01 151.62 48.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.601 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -106.18 144.28 15.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.99 -178.584 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.632 HD21 ' HB3' ' A' ' 61' ' ' GLU . 22.4 mt -101.71 150.88 22.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.566 -175.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 2.8 mm? -88.72 -173.49 4.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.151 170.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.23 -50.69 70.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 111.238 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -116.14 40.12 2.92 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.645 -177.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.463 ' HB2' ' H ' ' A' ' 83' ' ' LEU . 30.2 tp10 -76.1 -11.37 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 175.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 67.1 m 65.0 126.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 114.6 -1.182 . . . . 0.0 112.623 172.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.524 ' H ' ' HA ' ' A' ' 30' ' ' THR . 64.6 t -76.03 -42.26 38.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.559 -174.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -72.26 -38.61 68.8 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.635 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -62.06 -42.1 98.84 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.87 174.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.529 ' HA ' ' CE ' ' A' ' 94' ' ' LYS . . . -60.5 -43.95 96.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.638 176.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -61.17 -31.75 71.49 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.546 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.1 t -77.12 -13.84 59.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.111 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 64.4 mttt -85.1 -18.27 34.78 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.493 0.663 . . . . 0.0 110.285 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.503 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.9 m0 -62.32 145.79 52.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.355 -170.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.736 ' H ' HG21 ' A' ' 63' ' ' VAL . 20.5 mttp -115.41 23.8 12.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.754 -1.566 . . . . 0.0 108.169 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 175.89 -171.44 44.49 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-N 114.072 -1.422 . . . . 0.0 110.227 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.11 108.56 20.01 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 117.304 0.552 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.572 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -114.85 -151.02 10.05 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.829 -177.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.561 ' HD3' HD11 ' A' ' 20' ' ' LEU . 1.1 mtmp? -150.46 149.56 30.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.658 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -91.2 124.08 35.14 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.874 168.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.0 mp -111.5 129.44 66.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.304 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.567 ' HG ' HD13 ' A' ' 35' ' ' ILE . 3.8 mp -77.98 131.08 37.24 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.892 175.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.559 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.0 ttmm -145.87 -177.1 5.41 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 4.7 mp -106.57 135.71 47.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.92 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.72 ' HB3' HG13 ' A' ' 58' ' ' VAL . 16.5 ptmt . . . . . 0 C--N 1.312 -1.037 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.344 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.614 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 7.9 p . . . . . 0 N--CA 1.444 -0.736 0 CA-C-O 121.088 0.471 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.771 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 18.0 p90 -107.26 148.3 29.13 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -79.59 131.7 36.08 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.758 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.49 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.9 t -122.81 142.64 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.571 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.427 ' HB3' HD11 ' A' ' 20' ' ' LEU . 46.5 mt-30 -111.56 107.07 16.11 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 167.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.528 ' HB ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -122.63 139.65 48.86 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -175.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.693 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 92.5 m-70 . . . . . 0 C--N 1.314 -0.971 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.951 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.427 HD11 ' HB3' ' A' ' 10' ' ' GLN . 64.8 tp . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.26 108.76 7.24 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.489 -179.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.25 123.07 47.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 121.981 -0.449 . . . . 0.0 109.925 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.3 pt -130.36 175.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.147 0.499 . . . . 0.0 110.776 -178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 44.0 tttp -132.06 96.98 4.03 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 171.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.91 158.21 32.23 Favored Pre-proline 0 CA--C 1.5 -0.948 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.527 -176.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.712 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 8.1 Cg_exo -61.59 141.76 92.4 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.93 1.753 . . . . 0.0 111.625 -174.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.771 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.6 mtp-105 -61.79 -2.36 0.82 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.872 0.844 . . . . 0.0 110.235 -179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' A' ' 26' ' ' PRO . 3.4 p -107.67 -21.95 5.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.413 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.712 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 98.8 p -56.18 127.76 32.28 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 120.93 0.395 . . . . 0.0 110.353 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.495 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 7.7 p -95.27 -166.51 1.47 Allowed 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.477 ' HB2' HD13 ' A' ' 82' ' ' LEU . . . -59.26 -50.05 75.5 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.042 -177.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -60.72 -31.83 71.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 -178.067 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -73.29 -53.16 11.52 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 122.128 0.966 . . . . 0.0 109.797 -176.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.562 HG11 HG11 ' A' ' 88' ' ' VAL . 5.4 p -65.96 -27.96 42.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 113.771 -1.558 . . . . 0.0 110.29 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.548 HD12 ' HB3' ' A' ' 57' ' ' TYR . 4.3 mm -56.42 -56.52 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.134 170.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 34.6 tt0 -69.63 -33.4 72.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.384 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -62.03 -36.11 80.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.012 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.2 m -69.33 -37.3 77.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.899 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 7.4 mp -53.65 -44.21 69.41 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.157 0.503 . . . . 0.0 110.101 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.39 -36.19 82.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.08 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.34 -12.01 58.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.755 0.312 . . . . 0.0 111.56 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.547 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 m-20 . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.601 0.239 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.548 ' HB3' HD12 ' A' ' 35' ' ' ILE . 35.4 m-85 -103.56 145.82 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.829 -171.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.602 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -135.33 151.98 31.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.608 165.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.824 HD21 ' HB3' ' A' ' 101' ' ' PHE . 32.5 tp -104.51 147.17 27.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.041 0.448 . . . . 0.0 111.274 -174.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.573 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -102.84 124.9 49.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.732 176.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.667 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.5 pt-20 -88.82 87.31 7.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.232 1.015 . . . . 0.0 108.569 170.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.662 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 1.3 tt0 -85.86 124.47 32.37 Favored 'General case' 0 N--CA 1.426 -1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 109.685 175.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.57 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -118.18 113.8 43.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-O 121.188 0.518 . . . . 0.0 110.159 175.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.576 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.593 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.576 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.2 p . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.7 m -86.51 101.0 12.78 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.525 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.597 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 33.2 tt0 -93.91 129.86 40.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.86 -175.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.474 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 38.5 ttt-85 -125.84 147.38 49.46 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.573 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -101.65 143.24 14.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.362 178.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.563 HD22 ' HB3' ' A' ' 86' ' ' GLU . 45.3 mt -98.57 162.96 12.86 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.609 -176.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.588 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 58.6 mt -84.65 174.68 9.76 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 166.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.428 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 11.3 m-20 -55.05 -44.24 74.55 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.911 0.386 . . . . 0.0 110.546 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -121.35 53.36 1.17 Allowed 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.629 0.252 . . . . 0.0 111.374 176.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.588 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.2 OUTLIER -75.04 -4.29 37.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.559 174.283 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.495 ' HA ' ' HB ' ' A' ' 30' ' ' THR . 47.1 m 64.39 105.72 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.179 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.563 HG11 HD23 ' A' ' 59' ' ' LEU . 17.9 m -74.39 -27.37 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 O-C-N 122.311 -0.243 . . . . 0.0 111.585 -178.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -70.82 -38.58 73.27 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.459 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -63.65 -48.28 77.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.074 175.604 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.52 -50.51 67.69 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.401 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.502 ' OE1' ' HE2' ' A' ' 7' ' ' PHE . 20.8 tt0 -63.63 -37.18 86.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.707 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.4 p -75.4 -10.36 59.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.532 0.682 . . . . 0.0 110.263 176.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -101.94 -0.43 33.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.646 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.441 ' C ' ' HD3' ' A' ' 96' ' ' LYS . 40.3 m0 -75.62 158.42 32.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 122.131 0.967 . . . . 0.0 112.78 175.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.518 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.8 mppt? -126.94 29.87 5.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 113.466 -1.697 . . . . 0.0 109.228 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -175.36 -153.01 9.81 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.887 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -121.22 104.39 9.7 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.825 0.345 . . . . 0.0 110.248 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.662 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -114.56 -154.46 10.9 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.075 -1.059 . . . . 0.0 113.112 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.693 ' HD2' ' NE2' ' A' ' 12' ' ' HIS . 4.8 mtmp? -151.77 137.3 17.75 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.352 0.661 . . . . 0.0 109.76 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.824 ' HB3' HD21 ' A' ' 59' ' ' LEU . 92.3 m-85 -81.21 119.56 23.77 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.878 174.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 58.2 mt -110.26 120.16 60.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 O-C-N 121.993 -0.442 . . . . 0.0 111.122 -172.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.651 HD12 HD13 ' A' ' 59' ' ' LEU . 1.6 mp -71.08 128.55 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.394 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.512 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 18.3 ttmm -144.71 -177.76 5.67 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 175.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.512 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 38.7 mt -110.05 149.61 29.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.641 0.734 . . . . 0.0 111.852 -179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 19.0 ptmt . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.136 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.563 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 9.8 p . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 121.073 0.463 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.91 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.6 p90 -104.75 154.03 20.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -83.95 137.95 33.38 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.65 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.582 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.1 t -128.23 139.52 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.828 0.347 . . . . 0.0 110.265 176.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -107.58 106.29 16.57 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 165.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.69 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -116.45 134.38 60.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.698 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 . . . . . 0 C--N 1.312 -1.057 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.96 -178.048 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -92.14 109.94 21.31 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.336 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.9 p -91.82 112.74 26.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.782 0.801 . . . . 0.0 110.553 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.414 HG13 ' HB ' ' A' ' 9' ' ' VAL . 6.8 pt -121.17 171.19 10.2 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.741 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 41.5 tttp -129.25 96.12 4.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 172.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.22 161.57 22.5 Favored Pre-proline 0 CA--C 1.507 -0.706 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.324 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.956 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.9 Cg_exo -64.91 143.35 79.15 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 121.779 1.653 . . . . 0.0 111.817 -172.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.91 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 58.5 mtp85 -63.23 -1.68 1.13 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.317 0.579 . . . . 0.0 110.48 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.442 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.6 m -118.69 -0.88 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.524 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.956 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 84.4 p -59.89 139.09 57.61 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.132 0.491 . . . . 0.0 110.846 175.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.551 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -107.35 179.22 4.31 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.523 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.99 -48.97 61.22 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 123.206 0.316 . . . . 0.0 111.495 -175.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.431 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -59.65 -32.54 70.55 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.539 0.209 . . . . 0.0 110.911 -179.177 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.66 -54.18 9.75 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.059 0.933 . . . . 0.0 109.973 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.566 ' CG1' HD22 ' A' ' 59' ' ' LEU . 9.8 p -64.57 -27.34 42.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.748 -1.569 . . . . 0.0 109.849 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.647 HD13 HD12 ' A' ' 103' ' ' LEU . 6.1 mm -56.97 -56.15 16.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.066 167.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.9 tm0? -67.2 -34.64 77.93 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.791 -175.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -65.53 -48.95 70.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.477 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.456 ' HB ' HD13 ' A' ' 103' ' ' LEU . 20.6 m -63.68 -39.25 93.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.331 0.586 . . . . 0.0 110.14 178.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.45 -43.81 93.1 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.716 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.9 t -62.39 -33.98 75.82 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.734 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -75.33 -43.45 50.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.815 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.444 -177.678 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.593 ' C ' ' HG2' ' A' ' 106' ' ' LYS . 4.1 m-20 . . . . . 0 N--CA 1.448 -0.533 0 CA-C-O 121.324 0.583 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.672 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 31.7 m-85 -115.17 166.0 12.31 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.96 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.817 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -142.85 171.41 9.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.578 171.432 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.777 HD21 ' HB3' ' A' ' 101' ' ' PHE . 9.7 tp -124.0 145.48 49.17 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.7 mm? -98.78 130.34 45.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.631 179.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.604 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.7 pt-20 -95.55 84.92 4.05 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.404 1.097 . . . . 0.0 108.613 170.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.657 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 15.2 tt0 -85.62 124.23 31.93 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 121.465 -0.772 . . . . 0.0 108.961 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.522 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -114.46 110.09 30.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.514 HG23 ' HA2' ' A' ' 99' ' ' GLY . 61.3 t . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.721 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.455 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.6 m . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 m -82.23 99.53 9.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.562 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 25.8 tt0 -95.44 131.98 41.01 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 -174.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.478 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 21.7 tpp85 -129.1 159.98 34.28 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.671 HG13 HD13 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -118.21 145.77 23.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 118.442 0.565 . . . . 0.0 111.149 -175.669 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.453 HD12 ' HB3' ' A' ' 59' ' ' LEU . 42.4 mt -101.62 177.22 4.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.918 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' ASP . 30.4 tp -113.98 -49.39 2.86 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.929 0.492 . . . . 0.0 110.408 -175.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LEU . 3.5 p-10 178.46 -45.79 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.664 172.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.509 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 3.0 pt20 -117.35 34.65 5.02 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.0 mp0 -65.73 -14.78 61.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.863 -0.153 . . . . 0.0 111.213 173.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 68.2 m 66.88 104.87 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.558 0 O-C-N 123.795 0.684 . . . . 0.0 110.131 -174.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.551 ' H ' ' HA ' ' A' ' 30' ' ' THR . 15.2 m -74.79 -30.76 24.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -173.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -72.63 -37.86 67.91 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.554 -0.858 . . . . 0.0 108.804 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.685 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 9.0 mm100 -65.02 -43.54 92.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.913 173.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.48 88.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 0.0 110.223 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 88' ' ' VAL . 1.7 tt0 -57.94 -42.29 84.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.57 -177.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.5 p -72.84 -12.53 61.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.679 -177.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.685 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 70.0 mmtt -87.25 -16.32 35.56 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.196 0.522 . . . . 0.0 110.823 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.4 m0 -60.73 157.9 13.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.438 -176.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.438 ' H ' HG21 ' A' ' 63' ' ' VAL . 25.0 mtmm -129.85 28.3 5.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.725 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.486 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -178.22 159.02 24.23 Favored Glycine 0 N--CA 1.442 -0.941 0 CA-C-N 113.802 -1.544 . . . . 0.0 109.644 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.486 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -81.62 106.8 13.86 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 117.504 0.652 . . . . 0.0 110.684 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.657 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -110.47 -151.96 13.05 Favored Glycine 0 N--CA 1.434 -1.471 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.033 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.443 ' HG3' ' C ' ' A' ' 99' ' ' GLY . 8.2 mtmt -149.79 144.2 25.86 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.777 ' HB3' HD21 ' A' ' 59' ' ' LEU . 86.2 m-85 -82.11 152.55 26.5 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.315 169.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.81 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 76.2 mt -138.67 126.4 27.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.176 -0.327 . . . . 0.0 111.072 -174.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.647 HD12 HD13 ' A' ' 35' ' ' ILE . 4.7 tp -75.57 134.63 40.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.56 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 8.4 tppt? -150.52 176.32 11.07 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.672 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.3 tp -103.69 139.19 39.29 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.817 ' HB3' HG13 ' A' ' 58' ' ' VAL . 17.5 ptmt . . . . . 0 C--N 1.322 -0.616 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.009 -174.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.467 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 49.8 p . . . . . 0 N--CA 1.445 -0.677 0 CA-C-O 121.117 0.484 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.809 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.8 p90 -135.15 147.02 49.33 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -85.68 137.06 33.09 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.113 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.522 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.2 t -123.43 142.65 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.078 0.466 . . . . 0.0 110.477 176.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.482 ' HB3' HD11 ' A' ' 20' ' ' LEU . 38.9 mt-30 -110.62 107.38 16.95 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 166.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -123.18 139.11 50.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -177.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.487 ' HB2' HG12 ' A' ' 102' ' ' ILE . 10.5 m-70 . . . . . 0 C--N 1.315 -0.934 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.736 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 10' ' ' GLN . 65.4 tp . . . . . 0 N--CA 1.446 -0.661 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.423 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 8.3 m -70.33 109.2 4.58 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.666 -177.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.0 121.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 pt -129.71 164.3 32.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.745 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 28.7 tttp -118.14 105.27 11.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB1' ' HD2' ' A' ' 26' ' ' PRO . . . -112.03 169.24 6.55 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.22 -174.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.724 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.3 Cg_endo -75.43 141.02 24.97 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 122.147 1.898 . . . . 0.0 111.993 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.809 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.7 mtp-105 -61.8 -6.17 2.5 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 122.147 0.975 . . . . 0.0 110.166 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.437 ' CG1' ' HB2' ' A' ' 26' ' ' PRO . 3.0 p -103.97 -20.52 5.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.194 -178.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.724 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 95.1 p -58.04 126.59 28.13 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 120.851 0.357 . . . . 0.0 110.08 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.443 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 28.4 p -94.78 -164.78 1.21 Allowed 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.529 ' HB2' HD13 ' A' ' 82' ' ' LEU . . . -61.94 -50.18 73.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.83 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -59.59 -33.95 72.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.102 0.477 . . . . 0.0 110.48 -179.196 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -69.26 -53.26 20.75 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 122.163 0.982 . . . . 0.0 109.599 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.461 ' CG1' HD22 ' A' ' 59' ' ' LEU . 5.6 p -68.84 -28.24 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 CA-C-N 113.352 -1.749 . . . . 0.0 110.357 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.705 HD13 ' HG ' ' A' ' 103' ' ' LEU . 3.8 mm -57.16 -57.77 8.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.366 171.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.571 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 33.2 tt0 -68.06 -33.61 74.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.003 -175.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -59.29 -42.64 91.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.2 m -70.14 -37.04 75.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.917 176.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 3.5 mp -52.59 -47.45 66.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.327 0.584 . . . . 0.0 110.59 172.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 16.1 t -69.97 -29.28 66.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.212 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -81.88 -30.19 32.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.808 -176.489 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 11.7 m-20 . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 120.972 0.415 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.56 ' HB3' HD12 ' A' ' 35' ' ' ILE . 50.6 m-85 -101.54 145.1 29.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.653 -174.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -131.63 144.16 38.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.888 165.649 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.808 HD21 ' HB3' ' A' ' 101' ' ' PHE . 18.4 tp -97.03 142.56 28.82 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.407 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.541 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.4 mm? -98.44 129.62 45.06 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 176.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.657 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 12.4 pt-20 -93.25 87.76 5.78 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 170.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.5 tt0 -85.61 125.04 32.82 Favored 'General case' 0 N--CA 1.425 -1.694 0 O-C-N 121.045 -1.034 . . . . 0.0 109.783 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.652 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.82 112.65 39.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.322 0.582 . . . . 0.0 110.468 175.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.505 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.7 t . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.437 176.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 54.4 p . . . . . 0 N--CA 1.45 -0.465 0 CA-C-O 120.917 0.389 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.7 m -94.04 101.76 13.81 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.633 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.27 131.47 39.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.72 -175.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.506 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 33.8 ttt180 -124.63 153.85 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.541 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -109.26 130.17 62.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.552 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 31' ' ' ALA . 21.2 mt -85.83 165.65 16.67 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.515 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.509 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 75.0 mt -84.39 178.93 7.56 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 166.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 33.5 m-20 -55.22 -48.33 74.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.191 0.519 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -121.69 50.78 1.38 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.121 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.509 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -71.82 -3.96 25.19 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 174.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 32.6 m 66.11 104.69 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.188 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.447 HG13 ' CA ' ' A' ' 31' ' ' ALA . 23.6 m -74.45 -26.25 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.508 0 O-C-N 122.228 -0.295 . . . . 0.0 111.641 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -71.97 -35.18 69.44 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.501 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -66.32 -48.15 71.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.199 175.123 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.411 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -54.4 -48.83 71.14 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.969 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -56.94 -47.94 79.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.46 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.6 p -70.61 -6.67 38.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.448 0.642 . . . . 0.0 110.839 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 25.9 ttpp -106.66 0.25 24.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.106 -176.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.464 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -74.22 157.39 35.97 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.754 0.787 . . . . 0.0 112.906 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.652 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.6 mppt? -120.65 23.78 10.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.22 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 176.28 -175.06 47.36 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.344 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.46 104.99 16.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 117.386 0.593 . . . . 0.0 111.092 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.625 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -111.56 -145.98 10.22 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.42 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.37 145.46 13.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.225 0.61 . . . . 0.0 109.636 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.808 ' HB3' HD21 ' A' ' 59' ' ' LEU . 93.4 m-85 -79.96 140.8 36.49 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.991 175.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.487 HG12 ' HB2' ' A' ' 12' ' ' HIS . 70.0 mt -129.03 125.69 63.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 122.187 -0.321 . . . . 0.0 111.246 -173.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.705 ' HG ' HD13 ' A' ' 35' ' ' ILE . 6.4 mp -73.86 128.35 35.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.023 0.439 . . . . 0.0 111.219 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.508 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 21.1 ttmm -145.72 177.87 8.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 57' ' ' TYR . 18.1 mt -108.87 143.41 38.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.374 0.607 . . . . 0.0 112.041 179.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.621 ' HB3' HG13 ' A' ' 58' ' ' VAL . 18.9 ptmt . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.326 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.445 -0.679 0 CA-C-O 121.078 0.466 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.624 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 3.4 p90 -106.13 155.78 19.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -176.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -90.88 137.01 32.69 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.255 -174.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.603 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.2 t -122.49 141.0 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.625 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.579 ' HB3' HD11 ' A' ' 20' ' ' LEU . 45.8 mt-30 -111.43 109.24 19.11 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 165.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.73 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.4 p -135.83 137.9 48.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.776 0.322 . . . . 0.0 111.131 -173.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 111.195 -177.212 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.579 HD11 ' HB3' ' A' ' 10' ' ' GLN . 60.1 tp . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.59 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 25.7 m -80.14 108.92 14.12 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.197 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.44 114.92 33.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.471 0.653 . . . . 0.0 109.512 177.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.603 HG13 ' HB ' ' A' ' 9' ' ' VAL . 14.1 pt -124.77 174.15 9.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.985 -176.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -124.42 96.88 5.07 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 171.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.87 163.65 17.37 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.7 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.936 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.2 Cg_endo -70.08 144.16 51.47 Favored 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 121.925 1.75 . . . . 0.0 111.99 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.624 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 52.1 mtp180 -61.02 -8.82 3.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.394 0.616 . . . . 0.0 110.729 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -106.99 -5.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.99 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.936 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -56.2 126.64 27.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.55 0.69 . . . . 0.0 110.961 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.532 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.5 t -107.1 -179.15 3.85 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.057 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.69 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.56 -48.82 27.69 Favored 'General case' 0 C--O 1.211 -0.934 0 O-C-N 123.484 0.49 . . . . 0.0 111.822 -172.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.752 ' HA ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.46 -27.18 63.08 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.864 -177.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.83 -52.41 30.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 122.004 0.907 . . . . 0.0 108.978 176.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.45 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.38 -26.89 37.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.125 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 57' ' ' TYR . 8.4 mt -55.7 -57.55 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.261 169.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.0 tt0 -65.45 -32.65 74.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.831 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.467 ' HG2' HD12 ' A' ' 23' ' ' ILE . 45.5 tp60 -61.73 -45.15 95.19 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.165 0.507 . . . . 0.0 110.137 175.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.526 ' HB ' HD22 ' A' ' 103' ' ' LEU . 20.5 m -69.05 -38.39 79.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.89 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -50.65 -42.25 56.28 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.214 0.531 . . . . 0.0 110.67 171.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.36 -46.56 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.505 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -79.92 -19.91 46.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-O 120.878 0.371 . . . . 0.0 110.573 177.658 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.531 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 32.3 m-20 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.241 0.543 . . . . 0.0 111.298 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.78 ' HB2' HD13 ' A' ' 35' ' ' ILE . 11.8 m-85 -116.5 177.85 4.55 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.616 0.722 . . . . 0.0 110.63 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.42 HG22 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -148.26 -179.73 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.844 170.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.989 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -144.27 139.96 28.92 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.591 ' CD1' HG13 ' A' ' 81' ' ' VAL . 2.3 mm? -104.0 127.86 51.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.896 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.3 pt-20 -94.3 86.35 4.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.432 1.111 . . . . 0.0 108.39 167.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.557 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -86.71 123.66 32.12 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.078 175.232 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.567 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -115.64 118.33 58.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.224 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 84.4 t . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.231 0.539 . . . . 0.0 110.815 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.1 m . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 120.72 0.295 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.4 t -102.54 99.25 9.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.534 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 6.0 tt0 -94.97 132.05 40.24 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.028 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -129.22 144.09 51.09 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.591 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -103.78 141.1 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 118.71 0.686 . . . . 0.0 110.928 -178.024 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.656 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 7.8 mt -101.27 156.81 17.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.521 -176.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.6 mp -86.1 171.83 11.05 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 165.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.47 -31.38 55.62 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -176.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 6.9 pt20 -121.47 33.13 5.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -176.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.656 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 11.7 mm-40 -72.58 -11.74 60.77 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.559 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 55.5 m 68.08 118.61 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.403 0.621 . . . . 0.0 111.931 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.532 ' H ' ' HA ' ' A' ' 30' ' ' THR . 91.7 t -75.78 -37.08 34.76 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.864 -175.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -72.74 -38.78 67.28 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.559 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 18.1 mt-30 -58.36 -45.71 87.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.309 172.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.516 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.35 -50.99 70.7 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.117 178.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.446 ' OE1' ' HE2' ' A' ' 101' ' ' PHE . 12.1 tt0 -59.35 -24.97 63.81 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.674 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -82.93 -9.21 59.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.129 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 80.3 mttt -86.53 -24.18 25.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.201 0.524 . . . . 0.0 110.538 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.404 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 44.5 m0 -56.16 143.49 33.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.984 -1.007 . . . . 0.0 113.168 -168.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -124.87 20.21 8.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.255 -1.338 . . . . 0.0 108.891 177.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.509 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -168.17 155.22 25.78 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 108.526 -1.83 . . . . 0.0 108.526 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.04 103.92 11.18 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 118.08 0.94 . . . . 0.0 111.256 -176.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.567 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -109.64 -147.66 11.97 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.725 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.01 155.05 32.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.989 ' HB3' HD11 ' A' ' 59' ' ' LEU . 94.8 m-85 -85.35 151.4 24.05 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 168.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.582 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.5 mp -131.01 125.87 58.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 O-C-N 121.829 -0.544 . . . . 0.0 110.054 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.526 HD22 ' HB ' ' A' ' 38' ' ' THR . 25.0 tp -80.61 133.63 35.78 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -146.93 159.68 43.26 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 0.8 OUTLIER -82.89 150.77 26.3 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.634 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.2 ptmm? . . . . . 0 C--N 1.315 -0.91 0 CA-C-O 121.453 0.644 . . . . 0.0 109.307 176.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p . . . . . 0 N--CA 1.44 -0.947 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.607 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.2 p90 -132.21 152.18 51.44 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -85.86 129.76 34.74 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.023 0.439 . . . . 0.0 111.396 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.596 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.0 t -118.1 118.03 56.8 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.323 178.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.627 ' HB3' HD11 ' A' ' 20' ' ' LEU . 80.6 mt-30 -90.56 108.04 19.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 164.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.805 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -121.66 114.33 42.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 121.653 0.74 . . . . 0.0 111.135 -178.888 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.651 ' CD2' HD13 ' A' ' 20' ' ' LEU . 16.7 m-70 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.905 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.651 HD13 ' CD2' ' A' ' 12' ' ' HIS . 41.0 tp . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 21.6 m -85.58 108.45 17.97 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.425 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.4 t -94.22 111.78 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 O-C-N 122.055 -0.403 . . . . 0.0 110.306 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 9' ' ' VAL . 22.5 pt -123.15 170.3 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.161 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 tttt -119.16 113.73 21.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.408 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -115.43 168.49 8.22 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.742 -176.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.891 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.6 Cg_endo -75.38 143.46 27.91 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.01 1.807 . . . . 0.0 111.568 -179.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.607 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 67.2 mtt180 -59.31 -18.37 37.27 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.506 0.67 . . . . 0.0 110.495 -176.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.38 -14.34 9.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.137 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.891 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.1 p -55.42 128.52 34.68 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.753 0.787 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.526 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -111.23 177.55 4.62 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.364 176.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.74 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -49.78 -52.77 29.51 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 123.642 0.589 . . . . 0.0 111.306 -171.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.463 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.0 OUTLIER -57.17 -34.92 68.95 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.721 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.47 -52.4 10.78 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.467 0.651 . . . . 0.0 110.523 -175.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.738 HG11 HD22 ' A' ' 59' ' ' LEU . 3.3 p -62.54 -27.62 43.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.064 177.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.74 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.6 mm -56.01 -57.29 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.976 172.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.436 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 10.1 tt0 -71.82 -32.55 67.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -177.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -56.94 -37.77 71.99 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.04 0.448 . . . . 0.0 110.077 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.0 m -70.52 -38.5 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.965 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 9.2 mp -54.59 -43.62 72.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.851 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.2 t -71.07 -37.57 72.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.762 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -73.46 -25.43 60.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.885 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.465 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -172.553 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.526 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.2 m-20 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 120.883 0.373 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.602 ' HB3' HD12 ' A' ' 35' ' ' ILE . 61.1 m-85 -110.4 155.94 21.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 110.832 -177.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.02 146.75 21.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 170.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.781 HD21 ' HB3' ' A' ' 101' ' ' PHE . 16.1 tp -99.68 147.8 25.03 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.046 0.451 . . . . 0.0 110.803 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.621 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.4 mm? -106.1 133.34 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.594 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.676 ' HB3' HD21 ' A' ' 82' ' ' LEU . 11.8 pt-20 -94.59 85.23 4.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.706 1.241 . . . . 0.0 108.484 170.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.615 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 14.6 tt0 -86.12 122.86 30.74 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.387 -0.82 . . . . 0.0 109.262 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.538 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.9 OUTLIER -113.36 111.98 38.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-O 121.234 0.54 . . . . 0.0 110.173 176.552 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.641 HG23 ' HA2' ' A' ' 99' ' ' GLY . 79.7 t . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.177 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 57.0 m . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.531 ' HB3' HG13 ' A' ' 63' ' ' VAL . 20.7 t -80.29 99.35 7.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.25 131.26 40.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.536 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 35.6 ttt-85 -128.35 152.73 47.82 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.564 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.92 144.23 16.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.988 0.813 . . . . 0.0 110.719 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.676 HD21 ' HB3' ' A' ' 61' ' ' GLU . 16.9 mt -100.17 158.8 15.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.284 -176.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.8 mp -92.46 -179.19 5.13 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.0 -52.3 34.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.302 0.377 . . . . 0.0 111.337 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -119.52 51.59 1.15 Allowed 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.6 tp10 -73.12 -21.17 60.78 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.101 0.477 . . . . 0.0 109.738 170.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.704 ' HB2' HE21 ' A' ' 90' ' ' GLN . 54.9 m 73.7 124.98 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.267 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.524 ' H ' ' HA ' ' A' ' 30' ' ' THR . 89.4 t -75.05 -42.94 45.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.521 -173.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 92.9 t80 -73.02 -33.38 65.71 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.704 HE21 ' HB2' ' A' ' 87' ' ' CYS . 14.5 mt-30 -64.12 -41.25 97.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.568 172.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.182 0.515 . . . . 0.0 110.386 176.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -63.39 -28.66 70.14 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.643 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.8 p -78.65 -6.8 56.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.874 0.369 . . . . 0.0 110.934 178.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 34.3 mmtp -88.19 -22.04 24.24 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.302 0.573 . . . . 0.0 109.829 176.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.449 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.5 m0 -62.3 148.29 45.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.866 -173.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.538 ' H ' HG21 ' A' ' 63' ' ' VAL . 95.1 mttt -117.59 13.1 14.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.122 178.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -167.58 173.8 42.64 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.08 100.46 13.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 117.777 0.789 . . . . 0.0 111.208 -176.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.641 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -104.3 -145.11 13.91 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.997 -178.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.589 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -153.2 153.16 32.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 174.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.805 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.3 m-85 -87.95 122.59 31.75 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 170.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.621 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -101.19 123.61 54.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 O-C-N 121.81 -0.556 . . . . 0.0 110.444 -171.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.62 HD12 HD13 ' A' ' 35' ' ' ILE . 6.0 tp -74.99 127.19 32.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -147.03 170.25 17.53 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.1 mp -95.98 160.11 14.63 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 175.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 10.9 ptmm? . . . . . 0 C--N 1.31 -1.115 0 CA-C-O 122.11 0.957 . . . . 0.0 109.6 175.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.443 -0.804 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.713 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.3 p90 -137.74 155.04 49.5 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -177.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -90.21 133.74 34.73 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.063 0.459 . . . . 0.0 111.586 -174.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.587 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -119.52 121.23 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.274 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.569 ' HB3' HD11 ' A' ' 20' ' ' LEU . 95.9 mt-30 -95.56 108.45 20.7 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 166.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.77 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -125.43 123.44 64.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.393 0.616 . . . . 0.0 111.092 -175.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.56 ' HB2' HG13 ' A' ' 102' ' ' ILE . 63.2 m-70 . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.695 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 10' ' ' GLN . 58.3 tp . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 120.732 0.301 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.6 m -77.5 144.97 37.3 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 174.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.0 t -125.99 118.08 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.587 HG13 ' HB ' ' A' ' 9' ' ' VAL . 7.3 pt -127.41 169.48 18.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 tttt -120.59 104.16 9.72 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 171.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.576 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -102.35 170.02 6.87 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.792 -175.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.881 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 3.8 Cg_endo -75.75 142.65 25.89 Favored 'Trans proline' 0 N--CA 1.446 -1.321 0 C-N-CA 122.007 1.804 . . . . 0.0 111.302 178.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.713 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 77.9 mtt180 -59.89 -15.62 22.79 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.219 0.533 . . . . 0.0 110.82 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.91 -12.58 8.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.841 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.881 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.9 p -54.69 127.19 27.08 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.63 0.729 . . . . 0.0 110.829 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.578 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -107.95 -179.08 3.79 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.515 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.83 -51.52 29.07 Favored 'General case' 0 C--O 1.212 -0.897 0 O-C-N 123.579 0.549 . . . . 0.0 110.862 -172.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -37.8 69.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -70.7 -53.37 15.89 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 122.234 1.016 . . . . 0.0 109.966 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.651 HG11 HD22 ' A' ' 59' ' ' LEU . 3.0 p -66.05 -27.23 40.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 113.525 -1.67 . . . . 0.0 110.175 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.56 HD13 HD12 ' A' ' 103' ' ' LEU . 3.7 mm -56.12 -57.32 8.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.797 172.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.55 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 4.6 tp-100 -69.25 -33.6 73.5 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.576 HE22 ' HA ' ' A' ' 25' ' ' ALA . 32.6 tt0 -60.41 -42.3 95.72 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.859 0.361 . . . . 0.0 110.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.1 m -67.34 -37.07 82.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.046 174.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -55.18 -41.9 72.5 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.131 0.491 . . . . 0.0 110.611 172.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.5 t -72.65 -34.28 67.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.886 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -74.3 -39.29 63.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.013 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.473 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -172.147 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.537 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 18.0 m-20 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 120.622 0.248 . . . . 0.0 111.574 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 43.0 m-85 -111.55 153.64 25.95 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.918 0.39 . . . . 0.0 110.738 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.58 142.69 30.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.059 169.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.651 HD22 HG11 ' A' ' 34' ' ' VAL . 15.8 tp -93.66 145.33 24.63 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.07 0.462 . . . . 0.0 110.412 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.7 mm? -107.04 129.4 54.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.831 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.671 ' HB3' HD21 ' A' ' 82' ' ' LEU . 15.4 pt-20 -91.13 85.34 5.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.565 1.174 . . . . 0.0 108.283 169.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.639 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 14.3 tt0 -86.29 123.82 31.97 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.632 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.572 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -117.77 116.29 51.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.864 175.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.546 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 95.6 t . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 121.675 0.75 . . . . 0.0 110.385 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 2.0 p . . . . . 0 N--CA 1.445 -0.692 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -75.82 99.03 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.221 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.8 tt0 -94.49 131.44 40.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -175.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.541 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 3.6 tmt_? -132.93 137.41 46.6 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.558 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -98.05 137.41 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.679 -173.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.71 HD22 ' HG2' ' A' ' 86' ' ' GLU . 11.7 mt -94.04 168.64 10.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.258 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 83' ' ' LEU . 6.4 mp -107.82 -174.38 2.51 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.519 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -47.13 -53.71 12.26 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.397 0.435 . . . . 0.0 111.583 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 5.7 pt20 -125.25 67.54 1.13 Allowed 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.71 ' HG2' HD22 ' A' ' 82' ' ' LEU . 16.6 tp10 -77.49 -23.97 50.21 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 165.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 72.0 m 75.12 121.44 0.04 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.233 -174.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.503 ' H ' ' HA ' ' A' ' 30' ' ' THR . 78.2 t -75.2 -40.15 43.49 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-O 121.203 0.525 . . . . 0.0 110.383 -172.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 87.9 t80 -73.41 -32.73 64.6 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.637 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 12.9 mt-30 -69.82 -33.49 72.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.969 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.39 -43.7 66.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.245 0.545 . . . . 0.0 110.067 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -62.24 -29.44 70.4 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.506 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.8 p -81.02 -4.91 56.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.852 0.358 . . . . 0.0 111.277 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 32.7 mmtp -85.15 -24.18 28.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.472 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.0 m0 -61.74 148.02 44.29 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.41 -169.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -127.47 19.74 6.78 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.238 -1.347 . . . . 0.0 108.818 176.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -161.07 169.93 36.78 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.59 98.8 11.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 118.047 0.923 . . . . 0.0 111.137 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.639 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -110.65 -152.1 12.89 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 119.965 -1.112 . . . . 0.0 112.109 -177.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.522 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.9 mptp? -153.81 155.03 35.06 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.77 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 94.3 m-85 -85.19 126.73 33.89 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.937 -0.705 . . . . 0.0 109.147 171.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -103.2 124.35 57.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 O-C-N 121.771 -0.581 . . . . 0.0 110.633 -175.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.56 HD12 HD13 ' A' ' 35' ' ' ILE . 8.4 tp -81.84 105.5 13.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 18.5 ttmm -126.09 171.37 10.89 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.5 mp -92.58 162.3 14.24 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.7 ptmm? . . . . . 0 C--N 1.313 -1.002 0 CA-C-O 121.925 0.869 . . . . 0.0 109.617 174.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.442 -0.834 0 CA-C-O 121.112 0.482 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.951 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.0 p90 -136.53 153.18 51.08 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -89.05 130.29 35.53 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.331 -175.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.541 HG22 ' CE2' ' A' ' 7' ' ' PHE . 3.3 t -114.5 131.58 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.314 178.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 80.4 mt-30 -100.68 108.08 19.85 Favored 'General case' 0 N--CA 1.428 -1.557 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 162.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.755 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.06 113.98 40.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.591 ' HB2' HG13 ' A' ' 102' ' ' ILE . 83.2 m-70 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.168 -177.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.597 HD11 ' HB3' ' A' ' 10' ' ' GLN . 54.3 tp . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.561 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 99.6 m -82.14 109.49 16.5 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.703 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.4 t -93.09 111.51 24.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.513 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.5 pt -124.13 175.9 6.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.053 0.454 . . . . 0.0 111.209 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.0 tttt -124.0 110.56 14.93 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -110.42 169.43 6.36 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.635 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.957 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.2 Cg_endo -74.36 142.52 30.16 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 121.608 1.539 . . . . 0.0 111.382 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.951 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.1 mtt180 -64.53 -1.44 1.79 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.175 0.512 . . . . 0.0 111.279 -175.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 m -112.88 -6.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.95 175.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.957 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.9 p -50.0 139.84 13.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.509 0.671 . . . . 0.0 111.717 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.559 ' CB ' ' HA ' ' A' ' 87' ' ' CYS . 4.2 t -118.33 174.05 6.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.328 174.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.58 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.7 -52.02 44.13 Favored 'General case' 0 C--O 1.213 -0.838 0 O-C-N 123.707 0.629 . . . . 0.0 111.183 -171.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.416 ' HG3' ' OD2' ' A' ' 84' ' ' ASP . 0.0 OUTLIER -55.96 -33.81 65.11 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.564 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -76.07 -52.54 9.95 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.844 0.83 . . . . 0.0 110.46 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.594 ' CG1' HD22 ' A' ' 59' ' ' LEU . 6.0 p -64.43 -27.28 42.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 114.188 -1.369 . . . . 0.0 110.145 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.58 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.4 mm -56.46 -57.59 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.732 171.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 4.0 tp-100 -66.97 -34.33 77.52 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.948 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -58.87 -43.02 90.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 120.542 0.211 . . . . 0.0 110.855 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.44 HG21 HD22 ' A' ' 103' ' ' LEU . 15.6 m -68.3 -34.69 76.6 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 35' ' ' ILE . 8.1 mp -54.6 -54.48 40.81 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.234 0.54 . . . . 0.0 110.472 172.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.63 -34.99 79.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.875 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.31 -37.35 87.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.221 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.554 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -171.902 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 1.1 m-20 . . . . . 0 CA--C 1.52 -0.198 0 CA-C-O 121.147 0.499 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 38.3 m-85 -111.51 160.84 16.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.185 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.44 137.05 36.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.914 168.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.628 HD21 ' HB3' ' A' ' 101' ' ' PHE . 22.4 tp -89.94 140.51 29.55 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.205 0.526 . . . . 0.0 110.561 -177.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.569 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.6 mm? -101.67 128.89 47.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.731 178.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.602 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 14.3 pt-20 -92.18 84.25 5.21 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.353 1.073 . . . . 0.0 108.302 170.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.606 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 20.1 tt0 -86.08 121.86 29.29 Favored 'General case' 0 N--CA 1.425 -1.719 0 O-C-N 120.902 -1.124 . . . . 0.0 109.506 176.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.538 HG13 ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -104.37 104.47 16.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.358 174.059 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 61.3 t . . . . . 0 N--CA 1.449 -0.508 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.808 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 83.7 p . . . . . 0 N--CA 1.448 -0.549 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.538 ' HB3' HG13 ' A' ' 63' ' ' VAL . 22.7 t -91.0 102.64 15.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.606 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -95.14 131.35 41.25 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.075 0.464 . . . . 0.0 110.226 -175.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.572 ' HD3' ' OE2' ' A' ' 61' ' ' GLU . 32.7 ttt-85 -127.0 151.9 47.96 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.519 HG13 HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.17 140.14 27.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 118.851 0.75 . . . . 0.0 110.448 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.561 HD12 ' HB3' ' A' ' 59' ' ' LEU . 10.0 mt -93.69 165.5 12.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.551 0.691 . . . . 0.0 111.589 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.0 mp -96.12 -174.38 3.08 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.652 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.416 ' OD2' ' HG3' ' A' ' 32' ' ' GLN . 15.3 t70 -53.29 -51.11 63.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.275 0.559 . . . . 0.0 110.798 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.481 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 12.9 pt20 -125.84 55.54 1.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.574 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.0 tp10 -73.46 -23.03 60.03 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.712 ' HB2' HE21 ' A' ' 90' ' ' GLN . 7.5 m 76.0 132.15 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.013 -176.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.527 ' H ' ' HA ' ' A' ' 30' ' ' THR . 69.5 t -76.04 -42.81 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-O 121.176 0.512 . . . . 0.0 110.155 -174.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -73.0 -33.49 65.81 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.712 HE21 ' HB2' ' A' ' 87' ' ' CYS . 15.8 mt-30 -67.55 -36.79 81.65 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.157 173.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -45.35 70.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.557 0.694 . . . . 0.0 110.344 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.527 HE22 ' HE2' ' A' ' 7' ' ' PHE . 4.8 tt0 -61.7 -32.57 72.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.816 -177.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.5 p -76.24 -16.11 59.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.648 0.261 . . . . 0.0 111.432 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 24.5 mmtp -74.67 -27.31 60.36 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.365 0.603 . . . . 0.0 110.016 176.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.41 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -55.68 144.67 26.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.765 -1.107 . . . . 0.0 113.695 -169.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -108.04 14.74 24.93 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.222 -1.354 . . . . 0.0 109.255 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.36 -166.59 30.38 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.611 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -107.46 107.97 19.08 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 117.54 0.67 . . . . 0.0 110.999 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.595 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -116.68 -147.47 8.73 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.575 -0.822 . . . . 0.0 111.777 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.652 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -152.05 160.46 43.44 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 173.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.755 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 85.9 m-85 -88.87 123.91 33.69 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 169.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.8 mp -103.07 121.97 54.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 121.952 -0.468 . . . . 0.0 110.188 -175.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.566 HD12 HD13 ' A' ' 35' ' ' ILE . 7.8 tp -79.31 112.07 16.18 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HE2' ' HB2' ' A' ' 104' ' ' LYS . 17.7 ttmm -131.39 168.88 16.83 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 2.1 mp -91.53 161.17 15.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 14.3 ptmm? . . . . . 0 C--N 1.312 -1.027 0 CA-C-O 121.762 0.792 . . . . 0.0 109.486 174.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB2' ' HE2' ' A' ' 24' ' ' LYS . 17.4 m . . . . . 0 N--CA 1.45 -0.473 0 CA-C-O 121.296 0.569 . . . . 0.0 109.938 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.91 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.0 p90 -114.4 157.31 23.04 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -87.95 133.73 33.87 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.002 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.546 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -118.69 129.56 74.76 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.442 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.736 ' HB3' HD11 ' A' ' 20' ' ' LEU . 79.7 mt-30 -96.97 108.03 20.67 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 163.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.724 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.88 118.95 56.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.33 0.586 . . . . 0.0 110.499 178.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.584 ' HB2' HG13 ' A' ' 102' ' ' ILE . 29.1 m-70 . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.935 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.736 HD11 ' HB3' ' A' ' 10' ' ' GLN . 45.0 tp . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 50.6 m -83.36 108.05 16.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.419 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 56.5 t -95.65 111.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.546 HG13 ' HB ' ' A' ' 9' ' ' VAL . 12.8 pt -120.69 175.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.0 111.323 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 6' ' ' SER . 39.8 tttt -122.87 120.15 32.64 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 170.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -126.74 167.88 16.15 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -171.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.907 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.2 Cg_exo -68.2 139.59 46.63 Favored 'Trans proline' 0 N--CA 1.442 -1.52 0 C-N-CA 121.293 1.329 . . . . 0.0 111.429 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.91 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 42.3 mtt180 -66.72 -0.86 3.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.233 0.539 . . . . 0.0 110.701 -177.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.2 m -112.26 -9.1 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.979 174.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.907 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.5 p -46.45 139.59 4.85 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.891 0.853 . . . . 0.0 112.724 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.554 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 4.3 t -116.35 174.74 5.89 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.264 172.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.711 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.19 -50.79 48.28 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 123.579 0.55 . . . . 0.0 111.576 -171.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -34.63 70.1 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.43 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.33 -52.38 16.45 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.043 0.925 . . . . 0.0 110.084 -176.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.839 HG11 HD22 ' A' ' 59' ' ' LEU . 8.0 p -65.09 -27.94 43.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.261 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.711 HG12 ' O ' ' A' ' 31' ' ' ALA . 7.2 mm -56.77 -58.97 3.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.378 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 10.2 tt0 -73.77 -32.49 63.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.509 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.7 -42.72 84.31 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 120.781 0.324 . . . . 0.0 110.156 174.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.3 m -66.32 -38.06 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.017 175.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.574 HD13 ' O ' ' A' ' 35' ' ' ILE . 7.8 mp -53.5 -44.25 68.9 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.804 173.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.1 t -63.19 -34.14 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.258 0.551 . . . . 0.0 111.026 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -80.48 -21.58 41.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.216 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -172.905 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.533 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 60.5 m-20 . . . . . 0 CA--C 1.517 -0.302 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 35' ' ' ILE . 42.2 m-85 -113.09 151.9 30.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.066 0.46 . . . . 0.0 111.1 -175.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -138.8 142.92 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.765 170.732 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.839 HD22 HG11 ' A' ' 34' ' ' VAL . 19.6 tp -94.57 142.56 27.31 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.015 0.436 . . . . 0.0 110.014 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.543 HD12 ' HG2' ' A' ' 79' ' ' GLN . 2.1 mm? -106.45 125.06 50.52 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.633 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.655 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -88.62 85.47 6.82 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 122.505 1.145 . . . . 0.0 108.351 171.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.544 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 1.8 tm-20 -87.14 121.73 29.99 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.592 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -109.51 112.4 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.464 176.184 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.651 HG23 ' HA2' ' A' ' 99' ' ' GLY . 61.1 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.343 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.519 ' HB3' HG13 ' A' ' 63' ' ' VAL . 26.9 t -82.23 100.19 9.73 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.543 ' HG2' HD12 ' A' ' 60' ' ' LEU . 7.3 tt0 -93.47 131.49 38.64 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.59 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 30.7 ttt-85 -126.35 150.44 48.55 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.541 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.48 144.21 16.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 118.979 0.809 . . . . 0.0 110.328 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.553 HD12 ' HB3' ' A' ' 59' ' ' LEU . 15.7 mt -101.62 149.64 23.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.872 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 83' ' ' LEU . 6.2 mp -83.26 172.31 12.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.599 171.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -48.02 -48.98 32.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.221 0.534 . . . . 0.0 110.983 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -119.52 38.84 3.76 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.17 -176.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.1 tp10 -71.01 -21.83 62.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.986 0.422 . . . . 0.0 109.923 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.65 ' HB2' HE21 ' A' ' 90' ' ' GLN . 43.8 m 76.14 125.22 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.962 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.554 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.2 t -76.39 -39.41 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.078 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -72.88 -33.93 66.36 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.65 HE21 ' HB2' ' A' ' 87' ' ' CYS . 14.9 mt-30 -67.11 -30.05 69.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.958 174.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.66 -42.58 50.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.342 0.591 . . . . 0.0 110.397 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -56.78 -37.67 71.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.742 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 71.7 p -72.39 -13.9 61.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.818 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -78.1 -27.73 48.49 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 110.588 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.489 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.1 m0 -55.69 139.24 45.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -166.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.403 ' H ' HG21 ' A' ' 63' ' ' VAL . 88.8 mttt -109.59 14.12 23.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.787 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.84 176.13 45.04 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.747 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.69 99.08 10.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.692 0.746 . . . . 0.0 110.857 -177.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.651 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.97 -148.8 15.32 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.963 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.7 mptp? -150.15 155.61 40.11 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.744 ' HB3' HD21 ' A' ' 59' ' ' LEU . 99.2 m-85 -84.58 120.78 26.75 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 169.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.584 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -102.07 127.37 55.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.846 -0.534 . . . . 0.0 110.356 -174.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.427 HD12 HD13 ' A' ' 35' ' ' ILE . 8.9 tp -81.19 120.87 25.42 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.3 ttmm -140.63 175.64 9.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.2 mp -98.47 156.47 16.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HB3' HG13 ' A' ' 58' ' ' VAL . 19.2 ptmt . . . . . 0 C--N 1.312 -1.037 0 CA-C-O 122.092 0.949 . . . . 0.0 110.245 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.444 -0.734 0 CA-C-O 121.169 0.509 . . . . 0.0 109.972 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.593 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.3 p90 -104.3 150.0 24.84 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -80.53 120.67 24.81 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.189 -174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.571 ' HB ' HG13 ' A' ' 23' ' ' ILE . 19.1 t -107.06 135.53 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.424 175.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.577 ' HB3' HD11 ' A' ' 20' ' ' LEU . 56.9 mt-30 -112.69 109.04 18.3 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 165.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.731 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -131.49 122.82 51.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.112 -175.461 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.581 ' CD2' HD13 ' A' ' 20' ' ' LEU . 42.3 m-70 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.811 -176.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.581 HD13 ' CD2' ' A' ' 12' ' ' HIS . 51.9 tp . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.8 m -75.19 109.51 8.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.278 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -94.73 115.75 34.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.571 HG13 ' HB ' ' A' ' 9' ' ' VAL . 1.6 pt -130.97 130.06 63.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.363 -177.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -84.5 96.05 9.0 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -107.28 162.15 20.69 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.336 -173.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.869 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.6 Cg_exo -65.29 144.76 81.75 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.747 1.631 . . . . 0.0 112.158 -171.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.593 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 18.7 mtp180 -60.22 -11.28 5.9 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.609 0.719 . . . . 0.0 110.214 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.87 -4.41 9.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.46 177.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.869 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.8 p -58.33 124.6 20.05 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.495 0.664 . . . . 0.0 110.777 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.56 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.7 t -106.06 177.88 4.73 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.261 172.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.708 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.63 -50.33 24.72 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 123.564 0.54 . . . . 0.0 111.938 -171.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.691 ' HA ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.44 -27.56 63.35 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.634 -176.385 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.88 -49.34 53.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.895 0.855 . . . . 0.0 109.158 178.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 31' ' ' ALA . 2.3 p -69.18 -27.65 35.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.941 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.752 HD13 ' HB2' ' A' ' 57' ' ' TYR . 12.2 mt -56.64 -57.69 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.459 170.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.52 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 36.3 tt0 -66.1 -32.19 73.5 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.866 -176.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -59.44 -45.91 90.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-O 121.373 0.606 . . . . 0.0 109.686 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.4 m -64.82 -39.59 93.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.081 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.2 mp -50.79 -43.79 58.77 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.063 0.459 . . . . 0.0 110.828 173.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 86.0 m -63.46 -43.95 95.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.749 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -79.64 -16.41 55.83 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.582 0 CA-C-O 120.503 0.192 . . . . 0.0 111.089 179.3 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.522 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.0 m-20 . . . . . 0 N--CA 1.463 0.224 0 CA-C-O 121.117 0.484 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.752 ' HB2' HD13 ' A' ' 35' ' ' ILE . 16.4 m-85 -104.54 175.32 5.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.352 0.596 . . . . 0.0 110.189 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.505 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -144.28 180.0 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.339 169.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 1.081 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.7 tm? -144.19 137.51 27.45 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 -176.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.639 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.49 127.33 46.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.82 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.609 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.2 pt-20 -93.21 84.24 4.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.476 1.132 . . . . 0.0 108.549 169.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.627 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 7.3 tt0 -86.0 123.35 31.23 Favored 'General case' 0 N--CA 1.426 -1.659 0 O-C-N 121.624 -0.672 . . . . 0.0 109.956 176.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.527 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -113.77 116.13 51.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.647 HG23 ' HA2' ' A' ' 99' ' ' GLY . 97.4 t . . . . . 0 C--N 1.325 -0.47 0 CA-C-O 121.29 0.567 . . . . 0.0 110.601 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 50.4 m . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.711 0.291 . . . . 0.0 110.771 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.9 t -87.27 98.66 11.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.627 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 7.6 tt0 -97.7 131.67 44.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.726 -174.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.536 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 2.3 tmt_? -128.04 148.7 50.56 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.539 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -107.63 133.77 51.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 118.665 0.666 . . . . 0.0 111.005 -177.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.669 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 9.3 mt -93.14 166.61 12.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.394 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.469 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.7 mp -95.49 -176.8 3.88 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 165.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -59.67 -32.61 70.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.41 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 6.3 pt20 -125.28 38.58 4.15 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -176.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.669 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 13.3 mm-40 -75.38 -12.7 60.31 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.019 171.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.62 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 63.6 m 68.95 121.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.445 0.64 . . . . 0.0 111.943 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.56 ' H ' ' HA ' ' A' ' 30' ' ' THR . 74.9 t -75.75 -39.79 39.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.183 -173.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -72.58 -38.22 67.94 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.62 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 12.1 mt-30 -58.27 -46.77 85.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.51 172.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.18 -46.84 87.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.729 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -60.56 -26.98 67.32 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.181 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 t -75.12 -20.71 59.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -77.13 -23.12 51.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.361 0.6 . . . . 0.0 110.311 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.45 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.7 m0 -60.47 133.37 56.03 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.427 -172.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -113.16 11.85 18.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.695 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -156.77 167.78 33.73 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 109.081 -1.608 . . . . 0.0 109.081 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.77 105.65 17.94 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 118.02 0.91 . . . . 0.0 110.702 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.647 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -110.52 -142.84 9.4 Favored Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.586 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -158.1 160.32 37.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.104 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 1.081 ' HB3' HD11 ' A' ' 59' ' ' LEU . 95.8 m-85 -89.35 151.87 21.83 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 169.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.9 mp -132.69 128.89 58.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 O-C-N 121.933 -0.479 . . . . 0.0 110.465 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.438 HD11 HG12 ' A' ' 35' ' ' ILE . 12.8 tp -84.1 136.8 33.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -154.27 165.31 36.72 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -89.04 149.78 23.07 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 169.71 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.2 ptmm? . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.172 0.51 . . . . 0.0 109.947 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 p . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.883 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.1 p90 -130.2 149.8 51.74 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.413 ' CZ ' ' HD3' ' A' ' 24' ' ' LYS . 68.4 m-85 -89.42 138.31 31.56 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.858 -177.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.514 HG22 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -126.49 158.09 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.092 0.472 . . . . 0.0 109.888 176.265 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.513 ' HB2' HD11 ' A' ' 20' ' ' LEU . 5.2 pm0 -129.63 107.46 9.46 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 163.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -118.36 139.63 44.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.727 -174.692 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 . . . . . 0 C--N 1.315 -0.918 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.031 178.229 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.513 HD11 ' HB2' ' A' ' 10' ' ' GLN . 40.4 tp . . . . . 0 N--CA 1.447 -0.588 0 CA-C-O 121.004 0.431 . . . . 0.0 111.054 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.8 m -95.96 106.85 19.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.768 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.8 t -85.08 120.64 35.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.2 pt -130.92 168.73 23.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.891 0.377 . . . . 0.0 110.783 -177.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.413 ' HD3' ' CZ ' ' A' ' 8' ' ' PHE . 18.7 ttpp -124.87 111.93 16.05 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -117.92 164.73 18.53 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.002 -175.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.697 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 5.8 Cg_exo -68.23 143.91 60.67 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 122.203 1.936 . . . . 0.0 111.993 -179.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.883 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 44.7 mtp180 -64.81 -3.64 3.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.532 0.682 . . . . 0.0 110.449 -176.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.43 -7.9 11.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.697 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 0.8 OUTLIER -55.62 123.18 13.22 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 121.484 0.659 . . . . 0.0 111.875 174.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.615 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.2 t -100.47 178.91 4.6 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.96 170.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.532 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.34 -51.4 19.59 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.607 0.567 . . . . 0.0 111.238 -172.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.502 ' CA ' HE21 ' A' ' 32' ' ' GLN . 0.0 OUTLIER -61.89 -32.05 72.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -177.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.64 -52.19 16.41 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.787 0.803 . . . . 0.0 109.368 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.418 ' CG1' HD22 ' A' ' 59' ' ' LEU . 2.3 p -66.91 -29.29 45.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.064 -178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.891 HD13 ' HG ' ' A' ' 103' ' ' LEU . 5.7 mm -56.93 -58.39 5.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.086 172.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.449 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.2 tt0 -68.51 -32.04 71.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.699 -175.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 41' ' ' LYS . 6.3 tp60 -63.8 -37.4 87.25 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 120.985 0.422 . . . . 0.0 109.976 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 27.7 m -70.53 -36.03 73.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.88 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.9 mp -55.45 -36.57 66.7 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.445 0.641 . . . . 0.0 110.375 172.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.9 m -70.45 -38.58 74.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.105 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 75.1 mmtt -71.02 -28.09 64.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.788 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.557 -179.375 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.655 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.172 0 CA-C-O 121.041 0.448 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.584 ' HB3' HD12 ' A' ' 35' ' ' ILE . 6.7 m-85 -106.77 137.9 43.94 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.227 -176.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.717 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.8 OUTLIER -118.83 165.71 13.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 165.827 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.511 HD11 ' HB3' ' A' ' 101' ' ' PHE . 13.9 tp -117.89 138.46 52.11 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.559 HD13 ' HA ' ' A' ' 81' ' ' VAL . 2.6 mm? -98.51 126.08 43.95 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.703 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.1 pt-20 -88.66 86.43 6.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.596 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 10.8 tt0 -86.98 121.93 30.12 Favored 'General case' 0 N--CA 1.423 -1.817 0 O-C-N 120.702 -1.249 . . . . 0.0 108.733 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.501 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.4 OUTLIER -106.03 115.84 48.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 CA-C-O 121.425 0.631 . . . . 0.0 109.366 174.742 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.72 HG23 ' HA2' ' A' ' 99' ' ' GLY . 53.4 t . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.217 -176.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.45 -0.449 0 CA-C-O 120.87 0.367 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.48 ' HB2' HG13 ' A' ' 63' ' ' VAL . 20.3 m -104.27 103.06 12.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.587 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 16.2 tt0 -95.77 130.78 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -175.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -132.06 131.38 42.37 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.559 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -88.92 137.18 21.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.446 -173.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.509 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 17.9 mt -97.37 159.96 14.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.707 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.628 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 7.7 mp -86.92 -169.63 2.71 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 165.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.11 -36.12 82.31 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.695 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.478 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 3.4 pt20 -125.11 44.6 2.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.628 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 8.1 mm-40 -77.33 -9.66 58.97 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 122.174 -0.329 . . . . 0.0 110.875 172.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.684 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 16.7 t 74.41 129.32 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.088 0.955 . . . . 0.0 111.415 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.615 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.6 t -78.54 -46.85 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 109.778 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -72.41 -41.4 66.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.505 -174.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.684 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 8.7 mm-40 -63.26 -45.0 93.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.658 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.99 -51.26 69.95 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 110.493 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -55.49 -36.51 66.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.125 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.5 t -72.25 -15.73 61.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.454 -177.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 68.4 mmtt -90.9 -13.01 34.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.329 0.585 . . . . 0.0 110.737 -178.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 42.1 m0 -59.01 152.35 20.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.177 -174.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.489 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.3 mppt? -109.05 15.79 23.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.422 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -179.91 176.38 47.41 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 114.618 -1.174 . . . . 0.0 110.603 -176.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.485 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -94.38 106.63 18.61 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.512 0.656 . . . . 0.0 110.925 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.72 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.89 -146.76 13.48 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.073 -177.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -149.39 137.66 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.559 ' HB2' HG12 ' A' ' 11' ' ' VAL . 98.0 m-85 -84.34 146.31 27.78 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.521 -0.872 . . . . 0.0 109.324 169.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 71.3 mt -135.61 129.61 49.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 O-C-N 122.079 -0.388 . . . . 0.0 111.587 -171.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.891 ' HG ' HD13 ' A' ' 35' ' ' ILE . 9.1 mp -79.61 107.93 12.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 110.009 174.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.445 ' O ' HG23 ' A' ' 58' ' ' VAL . 32.2 ttpt -138.26 128.86 26.45 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.537 HD22 ' O ' ' A' ' 56' ' ' ASP . 19.3 mt -62.32 139.72 58.52 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.624 0.726 . . . . 0.0 112.895 -171.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.717 ' HB3' HG13 ' A' ' 58' ' ' VAL . 13.9 ptmm? . . . . . 0 C--N 1.313 -0.988 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.481 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.506 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HB3' HD11 ' A' ' 20' ' ' LEU . 45.8 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.797 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.548 ' HB2' HG13 ' A' ' 102' ' ' ILE . 78.2 m-70 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.58 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.862 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.675 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.535 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.832 HD13 ' HB2' ' A' ' 57' ' ' TYR . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.518 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 37.2 m-20 . . . . . 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' ' 35' ' ' ILE . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.598 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 1.044 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.735 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.648 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.543 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 120.862 0.363 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.611 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.51 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.546 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.411 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.657 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.641 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.57 ' H ' ' HA ' ' A' ' 30' ' ' THR . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 0.9 OUTLIER -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.496 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.482 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.648 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 1.044 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.735 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.598 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmm? . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.588 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 11.6 m . . . . . 0 N--CA 1.445 -0.683 0 N-CA-C 109.109 -0.701 . . . . 0.0 109.109 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.664 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 9.2 p90 -135.76 149.53 49.19 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -83.77 121.48 27.36 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.303 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' HG13 ' A' ' 23' ' ' ILE . 9.2 t -99.78 128.73 51.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.056 0.455 . . . . 0.0 110.38 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.55 ' HG3' HD11 ' A' ' 20' ' ' LEU . 8.7 tt0 -100.16 106.59 18.31 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 166.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.679 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -135.47 137.16 50.13 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.242 -176.383 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 . . . . . 0 C--N 1.321 -0.656 0 N-CA-C 112.127 0.418 . . . . 0.0 112.127 -173.344 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.55 HD11 ' HG3' ' A' ' 10' ' ' GLN . 46.1 tp . . . . . 0 N--CA 1.449 -0.489 0 CA-C-O 120.68 0.276 . . . . 0.0 110.626 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.3 m -104.06 110.26 22.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.193 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.8 p -99.75 128.29 51.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.301 0.572 . . . . 0.0 109.637 173.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.555 HG13 ' HB ' ' A' ' 9' ' ' VAL . 9.1 pt -137.66 159.97 34.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.696 -178.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.588 ' HE3' ' HB2' ' A' ' 6' ' ' SER . 18.8 tttp -114.48 97.8 6.52 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.457 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -110.31 169.31 6.5 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.055 -170.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.88 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.5 Cg_endo -71.9 140.1 34.44 Favored 'Trans proline' 0 N--CA 1.443 -1.442 0 C-N-CA 121.48 1.453 . . . . 0.0 110.612 -176.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.664 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 98.9 mtt180 -57.72 -36.48 72.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.8 -13.94 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 113.944 -1.48 . . . . 0.0 112.617 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.88 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 80.1 p -58.45 124.76 20.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.679 0.752 . . . . 0.0 110.757 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.552 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.2 t -100.66 179.63 4.36 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.927 171.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.67 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.51 -50.39 23.55 Favored 'General case' 0 C--O 1.209 -1.068 0 O-C-N 123.422 0.451 . . . . 0.0 110.745 -174.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.418 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.4 OUTLIER -59.69 -31.91 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -72.8 -53.35 11.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 122.168 0.985 . . . . 0.0 109.641 -176.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.682 HG11 HD22 ' A' ' 59' ' ' LEU . 2.6 p -65.42 -27.7 42.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.074 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.791 HD13 HD12 ' A' ' 103' ' ' LEU . 10.1 mm -56.74 -56.07 16.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.363 168.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.852 ' HA ' HD12 ' A' ' 39' ' ' LEU . 25.2 tp60 -59.98 -45.49 92.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.941 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -59.1 -39.17 81.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.649 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.505 ' HB ' HD13 ' A' ' 103' ' ' LEU . 29.5 m -69.02 -41.13 78.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.73 0.3 . . . . 0.0 110.293 176.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 36' ' ' GLN . 29.7 mt -56.8 -38.84 73.11 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 120.986 0.422 . . . . 0.0 110.308 175.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.03 -52.98 44.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.783 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -80.34 -9.26 59.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 O-C-N 122.396 -0.19 . . . . 0.0 111.097 179.789 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.539 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.7 m-20 . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 110.522 -0.177 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.632 ' HB3' HD12 ' A' ' 35' ' ' ILE . 49.5 m-85 -123.24 143.92 49.73 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.397 0.618 . . . . 0.0 111.799 -175.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.649 HG13 ' HB3' ' A' ' 106' ' ' LYS . 3.1 m -127.66 165.99 25.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.411 166.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.682 HD22 HG11 ' A' ' 34' ' ' VAL . 12.2 tp -112.59 152.02 29.38 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.911 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.6 OUTLIER -109.3 140.19 43.28 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.042 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.686 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.1 pt-20 -105.58 87.14 2.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.117 0.961 . . . . 0.0 109.096 170.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.645 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.1 tt0 -86.58 123.72 32.09 Favored 'General case' 0 N--CA 1.42 -1.939 0 O-C-N 121.19 -0.944 . . . . 0.0 109.376 173.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.552 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -111.82 117.59 55.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.578 HG23 ' HA2' ' A' ' 99' ' ' GLY . 92.7 t . . . . . 0 CA--C 1.514 -0.406 0 CA-C-O 121.601 0.715 . . . . 0.0 109.313 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.451 -0.41 0 CA-C-O 121.418 0.627 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.7 m -102.96 100.0 9.93 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.605 171.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.645 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 43.1 tt0 -94.33 132.69 38.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.942 -174.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.607 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 6.2 tpp180 -127.73 160.71 30.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.673 HG13 HD13 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -115.71 144.71 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 118.381 0.537 . . . . 0.0 110.474 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.666 HD21 ' HB3' ' A' ' 61' ' ' GLU . 20.8 mt -104.84 152.07 23.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.672 -174.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.415 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 7.3 mp -81.36 169.67 16.94 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 166.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -41.39 62.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.9 0.381 . . . . 0.0 111.389 -176.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.437 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 14.1 pt20 -114.09 32.03 6.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.59 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 22.6 tp10 -63.39 -20.69 65.75 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.992 0.425 . . . . 0.0 110.331 175.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.619 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 73.9 m 72.09 122.27 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.208 178.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.552 ' H ' ' HA ' ' A' ' 30' ' ' THR . 90.9 t -75.27 -38.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.25 -171.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -72.92 -33.96 66.29 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.619 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.1 OUTLIER -65.43 -40.57 93.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.192 176.781 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.515 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -68.88 -40.32 79.32 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.687 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.63 -36.03 79.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.135 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -70.51 -15.36 62.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.545 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 88.6 mttt -75.55 -24.98 56.75 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.011 0.434 . . . . 0.0 110.434 177.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.443 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.1 m0 -63.68 153.95 34.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -167.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mtmm -135.81 24.99 3.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.176 -1.375 . . . . 0.0 108.205 175.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.479 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -169.28 153.5 22.12 Favored Glycine 0 N--CA 1.44 -1.055 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.37 10.59 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.283 1.041 . . . . 0.0 111.062 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.578 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.38 -154.35 20.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.894 -176.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HB2' ' HE3' ' A' ' 100' ' ' LYS . 1.3 mtmt -146.32 143.88 29.43 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.679 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -80.42 153.06 28.5 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 169.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.911 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 92.9 mt -135.57 128.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 O-C-N 122.02 -0.425 . . . . 0.0 111.426 -173.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.791 HD12 HD13 ' A' ' 35' ' ' ILE . 3.4 tp -77.7 130.46 36.82 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 1.1 tppt? -151.61 175.79 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.568 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.7 mp -101.92 133.33 46.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.86 0.362 . . . . 0.0 110.416 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.649 ' HB3' HG13 ' A' ' 58' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.873 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.074 173.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.7 p . . . . . 0 N--CA 1.446 -0.655 0 CA-C-O 121.219 0.533 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.869 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -124.14 156.7 36.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.46 ' CZ ' ' HE2' ' A' ' 24' ' ' LYS . 43.7 m-85 -84.75 125.22 32.36 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.22 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.6 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.9 t -113.76 129.32 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.457 178.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.626 ' HB3' HD11 ' A' ' 20' ' ' LEU . 44.9 mt-30 -97.96 108.54 21.28 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 164.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.787 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -120.08 115.19 46.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-O 121.51 0.672 . . . . 0.0 110.406 177.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.63 ' CD2' HD13 ' A' ' 20' ' ' LEU . 9.4 m-70 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.266 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.63 HD13 ' CD2' ' A' ' 12' ' ' HIS . 27.0 tp . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.57 0.224 . . . . 0.0 110.489 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.6 m -92.06 109.45 20.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 173.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 50.0 t -95.81 110.69 24.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.6 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.2 pt -116.68 168.28 8.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.891 0.377 . . . . 0.0 110.706 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HE2' ' CZ ' ' A' ' 8' ' ' PHE . 19.0 tttm -117.1 96.05 5.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 169.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -100.47 167.49 10.82 Favored Pre-proline 0 CA--C 1.506 -0.712 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.461 -175.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.887 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 5.6 Cg_exo -68.74 141.98 51.27 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 121.535 1.49 . . . . 0.0 111.523 -177.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.869 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 35.5 mtp180 -66.33 -0.45 2.64 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.601 0.715 . . . . 0.0 109.966 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.415 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.5 m -114.12 -2.44 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.461 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.887 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.2 p -59.86 119.69 8.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.277 0.561 . . . . 0.0 109.859 175.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.496 ' C ' HG23 ' A' ' 88' ' ' VAL . 17.8 p -94.15 -173.82 3.21 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -55.8 -49.92 71.89 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.711 -176.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.43 HE21 ' C ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -61.92 -30.71 71.08 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -178.817 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -70.68 -53.74 14.54 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.485 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 31' ' ' ALA . 2.2 p -66.59 -27.6 40.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 113.599 -1.637 . . . . 0.0 110.135 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 31' ' ' ALA . 4.3 mm -55.88 -58.15 5.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.584 174.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.558 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 54.7 mt-30 -73.28 -32.77 64.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.752 0.31 . . . . 0.0 110.894 -175.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -60.99 -37.3 81.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-O 120.775 0.322 . . . . 0.0 110.216 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.609 ' HA ' ' HB3' ' A' ' 41' ' ' LYS . 32.6 m -75.68 -30.18 59.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.272 175.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 5.9 mp -55.68 -47.93 75.91 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-O 120.961 0.41 . . . . 0.0 109.943 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.8 m -67.16 -37.21 83.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.542 0.687 . . . . 0.0 110.161 176.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.609 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 27.9 tptp -69.86 -10.28 57.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.069 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.262 -179.742 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 CA--C 1.512 -0.51 0 CA-C-O 120.545 0.212 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.539 ' HB3' HD12 ' A' ' 35' ' ' ILE . 20.8 m-85 -118.54 134.45 55.08 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.259 0.552 . . . . 0.0 112.149 -171.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.87 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -108.69 178.8 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.445 163.158 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 1.108 HD11 ' HB3' ' A' ' 101' ' ' PHE . 3.0 tm? -131.04 132.84 45.21 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -98.83 125.97 44.35 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.546 -175.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.0 pt-20 -88.74 86.0 6.89 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.36 1.076 . . . . 0.0 108.508 170.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.607 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 17.9 tt0 -85.53 122.66 29.98 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.525 -0.735 . . . . 0.0 109.145 175.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.566 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.3 OUTLIER -115.61 117.92 57.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 121.449 0.642 . . . . 0.0 110.08 176.194 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.554 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 59.3 t . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.016 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 6.8 p . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 121.153 0.502 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.1 m -82.16 104.93 12.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.489 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.572 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 18.5 tt0 -94.34 131.21 40.21 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -176.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.521 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 29.4 ttt180 -126.68 149.85 49.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.548 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -105.8 139.5 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.822 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.685 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 23.6 mt -96.86 156.89 16.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.306 0.574 . . . . 0.0 111.578 -176.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.525 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 47.2 mt -76.98 168.45 20.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 162.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.16 -40.13 64.08 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -120.73 35.69 4.8 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.695 0.283 . . . . 0.0 111.669 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.685 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 23.9 tp10 -65.57 -17.68 64.76 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.638 ' HB2' HE21 ' A' ' 90' ' ' GLN . 18.9 m 78.2 109.48 0.07 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.521 176.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.496 HG23 ' C ' ' A' ' 30' ' ' THR . 86.8 t -55.71 -45.84 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.332 173.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -73.72 -35.54 65.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.66 -175.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.638 HE21 ' HB2' ' A' ' 87' ' ' CYS . 18.1 mt-30 -62.31 -45.37 93.56 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 173.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.24 90.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.677 177.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -54.41 -47.35 72.86 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.81 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.7 t -75.29 -4.44 39.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 0.0 110.466 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -99.35 -6.69 27.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.963 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.508 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -72.59 161.12 31.19 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.724 0.773 . . . . 0.0 112.541 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -128.77 21.59 5.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.02 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -178.0 169.59 41.5 Favored Glycine 0 N--CA 1.44 -1.078 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.248 -178.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.466 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -88.58 102.96 15.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 117.347 0.574 . . . . 0.0 111.376 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.607 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -111.09 -149.18 11.57 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.422 -0.894 . . . . 0.0 111.898 177.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.4 mptp? -152.61 155.01 36.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 1.108 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.4 m-85 -86.91 116.73 25.17 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 173.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.595 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -101.46 122.91 54.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 O-C-N 122.013 -0.429 . . . . 0.0 110.365 -173.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.506 ' CD1' HD13 ' A' ' 35' ' ' ILE . 7.5 tp -74.2 135.52 42.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -160.81 149.39 16.41 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.624 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.533 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 10.9 mp -70.39 141.68 52.15 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.204 174.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.87 ' HB3' HG13 ' A' ' 58' ' ' VAL . 14.3 ptpt . . . . . 0 C--N 1.317 -0.825 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.907 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p . . . . . 0 N--CA 1.444 -0.737 0 CA-C-O 120.904 0.383 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.531 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 6.0 p90 -147.87 155.46 41.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.5 ' CZ ' ' HD2' ' A' ' 24' ' ' LYS . 65.7 m-85 -87.08 129.61 34.84 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.188 -175.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.583 ' HB ' HG13 ' A' ' 23' ' ' ILE . 22.1 t -109.09 131.34 60.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.087 0.47 . . . . 0.0 110.767 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HG2' ' HG2' ' A' ' 100' ' ' LYS . 28.2 tt0 -101.57 106.49 17.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 166.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.626 ' HB ' ' HB2' ' A' ' 101' ' ' PHE . 1.8 p -139.57 137.89 39.82 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-O 120.883 0.373 . . . . 0.0 111.337 -172.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.596 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 94.0 m-70 . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.975 0.417 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 87.8 m -98.24 121.15 39.82 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.05 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.1 t -110.82 111.33 35.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 0.0 109.846 176.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.583 HG13 ' HB ' ' A' ' 9' ' ' VAL . 2.5 pt -124.12 159.83 29.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.298 -178.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HD2' ' CZ ' ' A' ' 8' ' ' PHE . 1.4 ttpm? -109.95 96.55 6.31 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 171.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.69 163.67 18.03 Favored Pre-proline 0 CA--C 1.504 -0.82 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.929 -175.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.984 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.3 Cg_exo -68.42 145.91 66.69 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.704 1.603 . . . . 0.0 110.974 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.531 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 73.6 mtt180 -62.02 -15.69 46.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.781 0.801 . . . . 0.0 109.634 -178.165 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.3 m -98.13 -4.59 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.3 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.984 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.7 p -55.72 123.25 13.52 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.786 0.803 . . . . 0.0 110.476 178.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.546 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 1.0 OUTLIER -103.53 174.61 5.79 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.991 173.246 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.15 -51.19 18.85 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 123.522 0.514 . . . . 0.0 111.331 -173.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.404 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 15.2 tp60 -60.92 -31.6 71.12 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.463 -178.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -78.76 -51.86 9.19 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 -177.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.447 HG11 HG21 ' A' ' 88' ' ' VAL . 2.9 p -60.55 -28.54 42.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.765 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.655 HD13 ' HG ' ' A' ' 103' ' ' LEU . 5.8 mm -56.45 -57.86 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.052 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.524 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 28.4 tt0 -70.76 -32.37 69.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.201 -174.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.402 HE22 ' HD3' ' A' ' 26' ' ' PRO . 28.1 tt0 -60.87 -38.01 84.11 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.978 0.418 . . . . 0.0 110.251 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.5 m -71.01 -31.92 68.56 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.078 175.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -62.42 -33.7 75.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.409 0.623 . . . . 0.0 110.806 173.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t -78.24 -36.74 46.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.812 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -70.98 -50.33 35.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.216 0.531 . . . . 0.0 110.179 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.023 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 8.1 m-20 . . . . . 0 CA--C 1.515 -0.388 0 CA-C-O 121.025 0.441 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.596 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 47.0 m-85 -107.62 156.52 18.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.093 -177.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.669 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.38 169.21 21.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 167.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 1.07 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -123.0 139.62 53.89 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -174.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.641 HD13 HG13 ' A' ' 81' ' ' VAL . 1.0 OUTLIER -103.11 128.63 49.96 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.017 -177.207 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.7 ' HG3' ' HB3' ' A' ' 80' ' ' ARG . 9.4 pt-20 -92.94 87.3 5.73 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.037 0.922 . . . . 0.0 108.96 171.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 9.7 tt0 -85.7 123.3 30.93 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.573 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.37 116.66 52.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.589 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t . . . . . 0 C--N 1.317 -0.814 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.309 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 19.8 m . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 m -92.97 103.9 16.18 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.2 tt0 -94.85 131.29 40.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.892 0.377 . . . . 0.0 110.217 -174.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.7 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 38.8 ttm180 -127.2 158.12 37.96 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.641 HG13 HD13 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -112.62 144.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 118.355 0.525 . . . . 0.0 110.819 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 19.8 mt -100.01 -177.07 3.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.31 0.576 . . . . 0.0 111.524 -176.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.794 ' H ' ' HB3' ' A' ' 86' ' ' GLU . 17.1 mt -117.62 -170.83 1.94 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.962 -179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.44 -30.66 71.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.164 0.507 . . . . 0.0 109.874 175.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.69 19.78 5.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -177.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.794 ' HB3' ' H ' ' A' ' 83' ' ' LEU . 13.7 tp10 -79.27 80.82 5.6 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 123.085 1.421 . . . . 0.0 107.771 169.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 58.1 m -35.63 135.45 0.28 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-N 110.257 -3.156 . . . . 0.0 113.68 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.535 ' H ' ' HA ' ' A' ' 30' ' ' THR . 55.3 t -76.16 -41.47 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.468 -175.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -72.44 -33.99 67.46 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.657 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 1.6 mt-30 -64.37 -42.19 96.3 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.299 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.549 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -63.19 -45.75 90.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.681 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -59.63 -29.72 68.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.693 -178.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.1 p -76.95 -20.69 55.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.343 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.549 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 75.1 mttt -73.02 -30.0 63.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.37 0.605 . . . . 0.0 110.209 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.485 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -49.09 128.84 17.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.872 -167.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.542 ' H ' HG21 ' A' ' 63' ' ' VAL . 22.4 mtpp -97.21 20.11 11.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.043 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 179.16 -171.56 43.55 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.595 -177.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -103.14 111.25 23.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.772 0.786 . . . . 0.0 110.768 178.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.573 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -116.45 -149.28 9.2 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.12 -177.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.688 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 2.0 mtmt -151.11 145.53 25.53 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 1.07 ' HB3' HD11 ' A' ' 59' ' ' LEU . 98.0 m-85 -79.2 154.22 29.41 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 67.3 mt -142.93 129.62 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 O-C-N 121.679 -0.638 . . . . 0.0 111.65 -174.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.655 ' HG ' HD13 ' A' ' 35' ' ' ILE . 5.8 mp -73.36 141.54 47.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.902 0.382 . . . . 0.0 110.98 176.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.487 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 9.3 tppt? -154.06 176.29 12.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.596 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.0 mp -101.28 142.57 32.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.164 0.507 . . . . 0.0 110.05 174.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.669 ' HB3' HG13 ' A' ' 58' ' ' VAL . 16.9 ptmt . . . . . 0 C--N 1.311 -1.07 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.008 -177.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.03 0.443 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 p 179.37 -160.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.53 -33.34 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -72.7 125.76 28.27 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.838 173.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.486 ' OE2' ' HD2' ' A' ' 27' ' ' ARG . 29.3 tt0 -104.82 141.12 37.07 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.21 -170.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.506 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m -91.01 133.33 35.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 168.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HB3' HD11 ' A' ' 20' ' ' LEU . 45.8 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.797 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.548 ' HB2' HG13 ' A' ' 102' ' ' ILE . 78.2 m-70 -77.26 143.52 38.85 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -135.48 170.22 16.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.492 ' CG2' HD11 ' A' ' 48' ' ' ILE . 10.4 m -86.24 -1.08 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-O 120.632 0.253 . . . . 0.0 111.584 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -62.48 128.89 92.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.984 0.421 . . . . 0.0 110.295 172.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.7 170.48 19.92 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.024 2.483 . . . . 0.0 113.011 -176.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 18' ' ' GLN . 11.8 tp10 61.43 94.2 0.04 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.927 -175.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 13.2 mm-40 66.33 76.52 0.29 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.146 -170.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.21 -32.1 93.96 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.677 2.251 . . . . 0.0 111.195 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp -80.8 106.45 12.81 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.618 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.58 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.862 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.675 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.535 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.832 HD13 ' HB2' ' A' ' 57' ' ' TYR . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -116.07 16.77 16.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.867 ' HA ' HD21 ' A' ' 49' ' ' LEU . 36.2 ttmt -62.45 110.15 1.58 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.237 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.512 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 32.8 m-85 70.7 -12.32 0.56 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.579 1.152 . . . . 0.0 112.142 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.4 m -54.72 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -99.05 6.78 46.45 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.42 ' C ' ' H ' ' A' ' 49' ' ' LEU . 30.3 t 57.45 42.72 24.16 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.275 -176.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.492 HD11 ' CG2' ' A' ' 14' ' ' VAL . 22.5 mm -63.52 -9.6 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.832 171.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.867 HD21 ' HA ' ' A' ' 43' ' ' LYS . 1.3 mm? -73.24 9.51 1.25 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.102 -1.408 . . . . 0.0 111.557 -171.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -59.94 -32.41 70.77 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -120.55 86.01 39.0 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.78 7.05 3.34 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.275 1.983 . . . . 0.0 113.012 -172.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.437 HD22 ' HB2' ' A' ' 55' ' ' SER . 5.7 p-10 -113.77 136.84 22.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.929 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.455 ' HB3' ' HB2' ' A' ' 36' ' ' GLN . 65.6 Cg_endo -75.61 7.51 3.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.122 2.548 . . . . 0.0 112.869 -175.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.453 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 4.2 m -88.23 -13.2 41.62 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.864 -174.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.518 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 37.2 m-20 -109.94 15.02 22.87 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 -176.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' ' 35' ' ' ILE . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.598 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 1.044 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.735 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.648 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.543 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t -67.72 112.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.437 ' HG2' HG22 ' A' ' 63' ' ' VAL . 24.7 mmmt -123.12 95.13 4.49 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.788 -1.096 . . . . 0.0 108.973 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 6.8 p-10 -60.77 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.402 -175.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.8 t -122.93 114.32 20.28 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.389 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 m -69.61 -36.62 76.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.212 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -87.02 -152.37 0.19 Allowed 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 70' ' ' LYS . 48.3 mtpt -113.81 81.51 1.54 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.199 0.523 . . . . 0.0 110.975 173.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -104.76 -31.57 9.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.602 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.494 HG22 ' H ' ' A' ' 74' ' ' THR . 14.5 m -139.33 143.87 38.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.386 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -64.61 -19.73 65.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.0 111.215 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.494 ' H ' HG22 ' A' ' 72' ' ' THR . 7.3 p -137.8 160.42 64.84 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.859 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.7 133.61 45.03 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.277 1.985 . . . . 0.0 111.598 172.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.582 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 21.3 pttp -112.87 164.92 12.82 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.61 -168.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m -113.63 139.98 48.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.008 -177.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.611 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.51 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.664 HG11 HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.411 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.657 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.641 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.57 ' H ' ' HA ' ' A' ' 30' ' ' THR . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 0.9 OUTLIER -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.496 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.482 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.648 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 1.044 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.735 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.598 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmm? -84.95 -19.69 31.77 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.67 -13.43 60.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.562 168.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -103.15 -8.87 20.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.307 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.664 HG21 HG11 ' A' ' 81' ' ' VAL . 0.5 OUTLIER -101.21 7.72 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.08 176.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -50.73 89.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 113.529 -168.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.27 18.04 0.48 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.285 -1.325 . . . . 0.0 107.991 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.5 t -104.81 60.61 0.69 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.861 -172.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.421 ' HB2' ' H ' ' A' ' 114' ' ' GLU . 13.6 mmt180 60.31 -92.53 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.328 175.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.421 ' H ' ' HB2' ' A' ' 113' ' ' ARG . 8.6 tp10 -147.97 143.52 27.36 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -113.86 -39.83 3.9 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.932 0.396 . . . . 0.0 110.754 -176.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.5 pttp . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.198 -177.274 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 t -75.08 121.73 22.49 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.446 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 1.3 pm0 -81.8 78.65 8.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.708 0.766 . . . . 0.0 111.397 -178.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.85 160.98 20.03 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.92 171.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -102.48 108.29 19.55 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.526 0.679 . . . . 0.0 111.378 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 p -139.95 137.77 35.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.76 175.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.772 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 12.5 p90 -113.8 154.77 26.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.061 -175.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -87.2 129.81 34.81 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 111.333 -176.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.584 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.5 t -115.73 127.82 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.348 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.584 ' HB3' HD11 ' A' ' 20' ' ' LEU . 34.6 mt-30 -102.05 107.09 18.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.783 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.6 OUTLIER -130.22 130.67 65.77 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.709 -174.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -74.63 138.67 43.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.466 -175.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -93.81 178.83 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.602 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.6 t -91.25 -23.95 5.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.885 0.374 . . . . 0.0 110.575 -178.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.465 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.7 t -97.95 142.79 25.13 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.894 0.378 . . . . 0.0 110.586 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 15' ' ' SER . 23.6 Cg_exo -64.81 -22.76 63.28 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.957 3.104 . . . . 0.0 114.755 -170.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -67.08 -19.55 65.67 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.057 -0.402 . . . . 0.0 111.523 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -124.01 78.41 58.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-O 120.907 0.384 . . . . 0.0 110.02 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.6 -37.66 28.15 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.542 2.161 . . . . 0.0 110.7 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.584 HD11 ' HB3' ' A' ' 10' ' ' GLN . 56.4 tp -134.71 103.21 5.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.172 174.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.625 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 29.7 m -82.09 109.44 16.41 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.341 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.12 111.22 24.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.923 0.392 . . . . 0.0 109.979 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.584 HG13 ' HB ' ' A' ' 9' ' ' VAL . 17.7 pt -122.36 173.25 8.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.778 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -122.03 97.61 5.56 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.22 160.28 30.16 Favored Pre-proline 0 CA--C 1.504 -0.795 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.755 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.856 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.8 Cg_exo -66.01 141.83 65.81 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 121.848 1.699 . . . . 0.0 111.386 -177.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.772 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 38.0 mtp180 -63.69 -0.57 1.03 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.609 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.435 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.6 m -114.35 -9.96 12.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.642 178.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.856 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.6 p -53.86 133.45 42.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 110.935 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 21.4 p -96.81 -169.99 1.97 Allowed 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.572 ' HA ' HG13 ' A' ' 88' ' ' VAL . . . -59.03 -48.55 81.19 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.248 178.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -57.45 -32.59 67.09 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 123.15 0.281 . . . . 0.0 111.398 -178.67 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -74.44 -53.74 8.96 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 122.245 1.022 . . . . 0.0 109.94 -176.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 88' ' ' VAL . 5.1 p -65.95 -27.47 41.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.126 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.823 HD13 HD12 ' A' ' 103' ' ' LEU . 3.1 mm -56.07 -58.22 5.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.141 171.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 28.2 tt0 -72.45 -32.33 66.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.293 -175.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -59.47 -35.26 73.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 122.106 -0.371 . . . . 0.0 110.683 176.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.9 m -68.89 -41.09 78.75 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 9.7 mp -54.13 -40.88 67.8 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.653 172.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.8 t -67.81 -33.31 74.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.468 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -73.18 -32.73 65.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.397 0.618 . . . . 0.0 109.972 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.473 ' HB1' ' HB ' ' A' ' 48' ' ' ILE . . . -97.91 26.15 5.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.423 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HA ' HD21 ' A' ' 49' ' ' LEU . 14.0 tptp -80.6 99.46 8.13 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.324 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.422 ' HD2' ' HG3' ' A' ' 43' ' ' LYS . 79.7 m-85 68.52 3.62 3.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.487 0.715 . . . . 0.0 112.915 177.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.9 m -64.26 -70.43 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.055 0.455 . . . . 0.0 110.51 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -111.97 14.82 20.87 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.372 -0.974 . . . . 0.0 108.372 172.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.2 t 59.37 92.13 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 113.702 -1.59 . . . . 0.0 111.351 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.473 ' HB ' ' HB1' ' A' ' 42' ' ' ALA . 2.0 tt -102.22 0.06 10.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 122.027 0.918 . . . . 0.0 108.975 175.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.455 HD21 ' HA ' ' A' ' 43' ' ' LYS . 48.6 mt -84.05 34.63 0.51 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.591 -162.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 p -68.35 -33.28 73.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 168.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -122.17 86.43 47.27 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.211 168.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.58 4.08 5.86 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.546 2.164 . . . . 0.0 111.677 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.496 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.7 p-10 -110.97 135.15 20.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.961 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.63 ' HB3' HG22 ' A' ' 35' ' ' ILE . 2.5 Cg_endo -81.68 6.58 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.746 2.297 . . . . 0.0 112.013 -179.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.516 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 6.1 m -71.3 -29.91 65.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.808 -173.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -97.5 8.87 43.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.985 0.421 . . . . 0.0 110.985 -176.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 29.9 m-85 -109.89 150.15 28.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.183 0.516 . . . . 0.0 111.098 -177.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -126.06 160.33 33.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.675 168.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 1.028 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.2 tm? -116.78 135.03 54.07 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.866 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.8 OUTLIER -98.41 130.71 45.04 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.09 -176.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.663 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.8 pt-20 -96.93 91.11 5.46 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.435 1.112 . . . . 0.0 108.52 169.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.658 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 3.3 tt0 -88.21 123.03 32.43 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 121.227 -0.921 . . . . 0.0 109.705 172.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.507 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -112.45 117.46 55.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.316 0.579 . . . . 0.0 109.564 169.836 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.67 HG23 ' HA2' ' A' ' 99' ' ' GLY . 51.8 t -86.5 118.76 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.21 -176.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' ' 65' ' ' LYS . 13.3 ptpt -110.71 90.5 3.34 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 168.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 3.7 p-10 -71.02 -97.86 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.3 -169.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.422 ' H ' ' CG ' ' A' ' 66' ' ' ASP . 1.9 t -157.92 88.78 0.98 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.604 0.716 . . . . 0.0 110.312 176.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 p -82.33 26.74 0.53 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.791 -177.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.405 ' HB2' ' H ' ' A' ' 70' ' ' LYS . 1.2 m-80 -120.79 -85.26 0.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.67 0.747 . . . . 0.0 109.222 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.826 ' HE3' ' HA ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -128.73 -142.7 0.26 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.691 177.244 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.43 ' H ' ' HB3' ' A' ' 70' ' ' LYS . 3.1 tppp? -94.55 64.53 3.06 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 171.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.3 m -79.66 100.94 8.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.989 -175.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.2 p 51.4 -117.95 1.19 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.468 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.0 p -127.35 151.1 74.25 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.06 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.582 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 80.8 Cg_exo -53.07 136.91 62.27 Favored 'Trans proline' 0 CA--C 1.514 -0.51 0 C-N-CA 122.797 2.332 . . . . 0.0 111.734 171.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -106.27 98.28 7.98 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.377 -171.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.7 p -79.82 103.91 10.04 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.509 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.422 ' HB2' HG13 ' A' ' 63' ' ' VAL . 17.9 m -83.86 96.94 8.94 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 176.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.0 tt0 -97.79 131.7 44.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.879 -0.601 . . . . 0.0 109.993 -175.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.573 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 24.5 ttt180 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.69 HG13 HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -110.35 140.55 28.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.482 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.5 mt -100.89 150.11 23.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.215 0.531 . . . . 0.0 111.653 -174.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.36 156.36 38.45 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 162.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.16 -32.99 38.37 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.811 0.338 . . . . 0.0 111.738 -175.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -110.38 19.64 18.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.8 -9.56 45.38 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.835 178.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 85.4 m 68.44 106.73 0.05 Allowed 'General case' 0 C--O 1.219 -0.537 0 O-C-N 123.931 0.769 . . . . 0.0 111.471 175.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 34' ' ' VAL . 17.0 m -72.34 -32.08 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.159 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -73.47 -37.19 65.86 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 118.881 -1.128 . . . . 0.0 109.042 178.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.637 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 57.4 mt-30 -62.0 -45.74 92.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.84 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.8 -44.03 81.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.74 -37.58 76.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.049 -178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 65.1 p -76.28 -11.99 60.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.835 0.35 . . . . 0.0 111.318 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 86.5 mttt -82.91 -21.8 34.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.228 0.537 . . . . 0.0 109.705 177.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.443 ' CG ' ' HB ' ' A' ' 63' ' ' VAL . 43.4 m0 -64.34 157.77 25.33 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.719 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.422 ' H ' HG21 ' A' ' 63' ' ' VAL . 62.2 mttm -137.7 19.23 2.87 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.174 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -160.6 165.61 35.11 Favored Glycine 0 N--CA 1.441 -0.978 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -86.76 104.76 16.45 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 117.99 0.895 . . . . 0.0 110.816 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.67 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -107.76 -147.61 13.47 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.147 -1.025 . . . . 0.0 112.147 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -150.43 153.93 36.81 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 176.136 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 1.028 ' HB3' HD11 ' A' ' 59' ' ' LEU . 96.8 m-85 -87.0 154.74 20.54 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 166.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.866 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 4.9 mp -135.18 127.18 47.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 121.66 -0.65 . . . . 0.0 110.951 -178.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.823 HD12 HD13 ' A' ' 35' ' ' ILE . 7.6 tp -83.14 127.53 33.68 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.606 ' HG2' ' CG2' ' A' ' 109' ' ' VAL . 5.6 tppt? -149.11 175.82 11.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.573 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.1 mp -98.17 144.17 27.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 0.0 110.491 172.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.725 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmt -85.31 -21.82 28.79 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.166 -176.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -83.83 4.73 27.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.424 0.63 . . . . 0.0 110.392 174.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -121.78 -38.15 2.78 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.606 ' CG2' ' HG2' ' A' ' 104' ' ' LYS . 57.3 t -88.7 75.21 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 164.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -90.81 9.52 29.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.153 -174.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.14 8.72 12.27 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.896 171.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 15.2 m -92.81 -0.19 57.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.346 -178.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -101.26 88.59 3.52 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.317 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -77.73 81.9 4.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.618 0.723 . . . . 0.0 109.146 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -89.06 178.46 6.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.507 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.995 -176.384 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.7 m . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 120.696 0.284 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t -145.04 157.98 43.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.241 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -80.25 -5.94 57.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.594 0.235 . . . . 0.0 111.059 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -84.6 3.04 38.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.396 0.617 . . . . 0.0 110.256 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -136.44 115.18 12.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.209 176.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.406 ' OG ' ' HE2' ' A' ' 24' ' ' LYS . 57.1 p -157.3 155.16 30.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.322 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.626 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 6.9 p90 -148.66 153.5 38.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -90.9 128.25 36.69 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.505 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.575 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.6 t -108.97 125.66 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.254 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.606 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 84.1 mt-30 -93.61 107.38 19.24 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.794 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -124.14 115.69 45.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.429 0.633 . . . . 0.0 110.576 -178.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.584 ' HB2' HG13 ' A' ' 102' ' ' ILE . 45.0 m-70 -69.68 145.48 52.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.601 -175.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.89 167.03 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.53 -21.57 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.387 0.613 . . . . 0.0 109.613 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.2 m -75.67 160.7 78.54 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.222 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.499 ' O ' ' HB3' ' A' ' 17' ' ' GLU . 61.1 Cg_endo -73.81 -144.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.627 2.218 . . . . 0.0 111.822 174.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 16' ' ' PRO . 8.0 tp10 71.66 -64.26 0.39 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.6 tp60 -155.06 96.85 2.48 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -52.84 -35.53 70.4 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.037 2.491 . . . . 0.0 112.446 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.561 HD11 ' HB3' ' A' ' 10' ' ' GLN . 52.7 tp -105.04 96.42 6.52 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.526 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 34.1 m -71.43 108.95 5.1 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.202 -176.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.4 t -96.14 111.06 25.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.4 pt -118.8 176.51 3.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.701 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.406 ' HE2' ' OG ' ' A' ' 6' ' ' SER . 51.4 tttt -124.9 97.75 5.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -98.86 170.98 6.22 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.138 -176.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.873 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.8 Cg_endo -75.64 140.8 24.14 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 C-N-CA 122.165 1.91 . . . . 0.0 110.14 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.626 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 90.7 mtt180 -54.24 -42.92 70.43 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 m -68.63 -10.37 13.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.951 178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.873 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 85.9 p -57.02 128.77 38.66 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.422 0.63 . . . . 0.0 110.783 177.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.514 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -102.3 179.19 4.38 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 171.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.787 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.42 -50.3 31.61 Favored 'General case' 0 C--O 1.213 -0.865 0 O-C-N 123.297 0.373 . . . . 0.0 111.013 -174.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.88 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -56.35 -35.45 67.65 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.611 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.96 -52.97 11.15 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.935 0.874 . . . . 0.0 110.021 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 59' ' ' LEU . 5.3 p -63.13 -27.44 43.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.89 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.787 HG12 ' O ' ' A' ' 31' ' ' ALA . 3.5 mm -55.75 -58.26 5.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.128 173.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.488 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 6.3 tp-100 -69.39 -33.63 73.31 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.024 -177.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.435 HE22 ' HA ' ' A' ' 25' ' ' ALA . 17.6 tt0 -65.52 -36.67 84.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.48 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.2 m -70.52 -35.62 73.27 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.552 HD13 ' O ' ' A' ' 35' ' ' ILE . 6.9 mp -54.44 -46.21 73.22 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.443 171.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.06 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -79.95 -23.3 41.79 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.777 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.5 ' HA ' ' CD1' ' A' ' 46' ' ' TYR . . . -101.66 -18.84 15.67 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -172.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.582 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -56.8 115.58 2.66 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.03 -179.104 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.796 ' HA ' HD21 ' A' ' 49' ' ' LEU . 84.1 m-85 68.42 -43.45 0.49 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.496 1.118 . . . . 0.0 111.461 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.4 ' H ' ' C ' ' A' ' 43' ' ' LYS . 35.1 m -49.9 -61.14 2.31 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.108 0.963 . . . . 0.0 111.927 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 42' ' ' ALA . 2.7 m-85 -95.69 15.43 20.07 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 46.59 37.4 4.46 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 114.259 -1.337 . . . . 0.0 111.489 -170.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.494 ' HB ' ' HB1' ' A' ' 42' ' ' ALA . 30.6 mm -86.23 85.55 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.103 173.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.796 HD21 ' HA ' ' A' ' 44' ' ' TYR . 2.7 mm? -124.92 -7.56 7.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.483 -178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -66.53 -43.41 85.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.407 . . . . 0.0 110.531 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.03 90.25 48.7 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.564 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -86.19 -1.49 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.047 2.498 . . . . 0.0 111.793 176.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -95.45 127.71 40.96 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.482 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.88 ' HB2' HE22 ' A' ' 32' ' ' GLN . 83.9 Cg_endo -80.45 2.02 8.82 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.9 2.4 . . . . 0.0 112.6 -175.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 p -77.08 -32.23 56.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.139 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 15.5 m-20 -88.78 -2.32 58.53 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.446 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.619 ' HB3' HD12 ' A' ' 35' ' ' ILE . 50.0 m-85 -103.69 152.94 21.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.482 0.658 . . . . 0.0 111.425 -175.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -136.03 161.89 37.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 168.621 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 34' ' ' VAL . 21.1 tp -115.29 148.39 39.26 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.484 -0.487 . . . . 0.0 109.98 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.3 mm? -106.44 134.56 49.39 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.796 ' HB3' HD21 ' A' ' 82' ' ' LEU . 12.6 pt-20 -98.87 87.34 3.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 122.378 1.085 . . . . 0.0 108.665 170.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.615 ' HB2' ' HG3' ' A' ' 79' ' ' GLN . 0.4 OUTLIER -87.07 124.47 33.26 Favored 'General case' 0 N--CA 1.414 -2.255 0 O-C-N 121.656 -0.652 . . . . 0.0 109.757 174.73 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.595 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.6 OUTLIER -113.86 111.25 35.21 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.422 174.054 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 92.5 t -59.17 105.21 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 121.389 0.614 . . . . 0.0 110.046 174.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.49 ' HD2' ' HA ' ' A' ' 65' ' ' LYS . 9.6 mmmt -110.0 102.45 11.18 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.06 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.42 145.42 11.35 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.713 171.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.433 HG21 ' NZ ' ' A' ' 76' ' ' LYS . 4.9 t -139.89 15.88 2.48 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.9 m -57.74 -61.84 2.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.33 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 54.63 -89.38 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.404 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -105.0 -45.17 4.61 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.749 -167.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HG2' ' N ' ' A' ' 72' ' ' THR . 3.8 ttmp? -104.33 164.17 11.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.333 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.431 ' N ' ' HG2' ' A' ' 71' ' ' LYS . 24.1 m -67.46 96.71 0.53 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.324 0.583 . . . . 0.0 109.977 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -137.58 133.84 34.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.714 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 p -66.32 144.48 98.73 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.465 -176.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.11 151.32 73.61 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.867 2.378 . . . . 0.0 112.314 177.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.433 ' NZ ' HG21 ' A' ' 67' ' ' THR . 50.2 mttp -109.99 175.32 5.48 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.727 -176.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.6 p -134.41 110.79 9.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.029 0.443 . . . . 0.0 109.876 176.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.517 ' HB3' HG13 ' A' ' 63' ' ' VAL . 11.9 t -87.6 99.28 11.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.615 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 6.9 tt0 -94.93 131.69 40.58 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.273 -0.422 . . . . 0.0 109.927 -175.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.657 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 27.1 ttt180 -126.72 157.57 38.74 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.899 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -111.99 144.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 118.482 0.583 . . . . 0.0 110.104 177.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.963 HD22 ' HG2' ' A' ' 86' ' ' GLU . 16.5 mt -103.17 154.64 19.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.237 0.541 . . . . 0.0 111.575 -173.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.7 mp -87.24 176.0 7.77 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.758 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -47.27 -51.31 19.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.463 0.477 . . . . 0.0 111.475 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -115.03 41.64 2.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.963 ' HG2' HD22 ' A' ' 82' ' ' LEU . 14.1 tp10 -62.34 -28.46 69.77 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.64 ' HB2' HE21 ' A' ' 90' ' ' GLN . 22.9 m 73.21 122.04 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.482 -175.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.503 ' H ' ' HA ' ' A' ' 30' ' ' THR . 94.0 t -74.68 -36.97 42.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.024 -173.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' A' ' 27' ' ' ARG . 86.7 t80 -73.39 -34.3 65.46 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.64 HE21 ' HB2' ' A' ' 87' ' ' CYS . 13.8 mt-30 -64.92 -44.73 88.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.87 175.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.479 ' HA ' ' NZ ' ' A' ' 94' ' ' LYS . . . -62.9 -46.69 86.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.039 0.447 . . . . 0.0 110.452 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -56.16 -38.8 71.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.372 -178.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.7 p -74.3 -5.01 39.64 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.479 ' NZ ' ' HA ' ' A' ' 91' ' ' ALA . 10.8 mttp -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.2 0.524 . . . . 0.0 110.643 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.429 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 44.6 m0 -64.41 155.36 32.77 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.871 -173.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.47 ' H ' HG21 ' A' ' 63' ' ' VAL . 98.8 mttt -130.8 18.34 5.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.13 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -163.7 166.79 37.53 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 109.278 -1.529 . . . . 0.0 109.278 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.31 93.27 8.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 118.018 0.909 . . . . 0.0 111.088 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.605 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -100.98 -150.23 23.97 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.206 -0.997 . . . . 0.0 112.024 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.606 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -151.89 155.56 38.35 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 175.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.794 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.5 m-85 -86.52 124.48 32.88 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -102.17 122.09 54.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.801 -0.562 . . . . 0.0 110.397 -174.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.9 tp -75.29 135.49 40.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.5 ttmm -156.86 176.6 12.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.586 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 6.6 mp -104.19 143.98 32.21 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.49 ' N ' HG22 ' A' ' 58' ' ' VAL . 12.1 ptmm? -69.62 -23.52 63.52 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.186 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.817 ' HA ' ' HG2' ' A' ' 110' ' ' GLN . 28.5 mt-10 -83.3 -12.92 56.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.534 177.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.466 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 82.4 mt-30 -94.58 -16.29 23.36 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.899 HG11 HG11 ' A' ' 81' ' ' VAL . 64.4 t -105.21 12.3 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 114.345 -1.298 . . . . 0.0 109.863 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.817 ' HG2' ' HA ' ' A' ' 107' ' ' GLU . 16.7 mm-40 -63.52 167.76 5.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.468 173.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.09 72.41 0.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.585 0.707 . . . . 0.0 110.153 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 64.3 m -87.24 166.82 14.63 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.125 -171.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 113' ' ' ARG . 56.5 mmt-85 -118.87 102.82 9.07 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 67.14 -71.35 0.1 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.014 0.821 . . . . 0.0 110.026 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -147.91 124.36 10.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 171.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm . . . . . 0 N--CA 1.466 0.343 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.7 -178.666 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.872 0.368 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 m -96.52 27.41 3.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.767 -176.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 47.71 56.58 6.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.938 -167.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.448 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 8.4 mp0 -35.45 114.77 0.27 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.974 177.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.41 ' HB2' ' HD2' ' A' ' 27' ' ' ARG . 5.2 pt-20 -105.1 144.22 32.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.409 -0.814 . . . . 0.0 113.08 -164.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.452 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 54.3 p -119.19 147.81 43.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.109 176.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.936 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.4 p90 -116.51 152.49 33.97 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.426 ' CE2' ' HD3' ' A' ' 24' ' ' LYS . 69.4 m-85 -89.42 131.8 35.3 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.445 -175.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.517 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.8 t -122.33 155.85 27.25 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 176.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.405 ' HB2' HD11 ' A' ' 20' ' ' LEU . 5.1 pm0 -129.46 107.3 9.38 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 163.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -115.04 140.07 38.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.477 -176.77 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -88.42 128.67 35.53 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.863 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -102.09 154.79 18.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.61 75.5 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.34 0.591 . . . . 0.0 110.399 -177.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.469 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 33.3 p -157.8 146.41 14.4 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.271 178.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 15' ' ' SER . 7.4 Cg_exo -74.5 -159.31 0.09 OUTLIER 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.866 2.377 . . . . 0.0 112.584 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 71.22 -60.51 0.51 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.84 0.856 . . . . 0.0 110.392 -173.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.474 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.4 tp60 -143.25 100.15 5.32 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.98 -22.19 62.88 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.442 2.761 . . . . 0.0 113.532 -172.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 10' ' ' GLN . 58.9 tp -107.99 137.33 46.17 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.257 -0.277 . . . . 0.0 110.362 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.5 HG22 HG23 ' A' ' 23' ' ' ILE . 20.7 m -112.1 107.94 17.05 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.506 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.3 t -86.43 111.06 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.5 HG23 HG22 ' A' ' 21' ' ' THR . 9.9 pt -125.34 119.09 54.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.957 0.408 . . . . 0.0 111.779 -176.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HD3' ' CE2' ' A' ' 8' ' ' PHE . 21.3 ttpp -79.8 118.51 21.65 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.59 161.84 56.67 Favored Pre-proline 0 C--N 1.318 -0.801 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.665 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 7.5 Cg_exo -62.75 142.51 89.35 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 121.915 1.743 . . . . 0.0 111.907 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.936 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 46.4 mtp180 -63.51 -1.2 1.11 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.49 0.662 . . . . 0.0 110.015 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.4 m -107.9 -11.71 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.204 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.665 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 2.9 m -54.69 124.04 15.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.729 0.776 . . . . 0.0 112.826 176.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.627 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -98.33 177.47 5.36 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.545 171.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.35 -51.43 26.27 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.44 0.462 . . . . 0.0 111.362 -172.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.435 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -64.82 -31.59 72.89 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.081 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -42.95 43.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 110.152 -176.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.52 ' CG1' HG21 ' A' ' 88' ' ' VAL . 1.3 p -72.5 -29.2 30.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.696 176.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.566 HD12 ' HB3' ' A' ' 57' ' ' TYR . 5.9 mm -56.51 -57.33 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 171.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.497 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 26.7 tt0 -64.5 -31.43 72.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.934 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 34' ' ' VAL . 6.2 tp60 -63.44 -40.79 98.09 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.145 0.498 . . . . 0.0 109.765 175.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 m -67.92 -32.09 72.3 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.693 175.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.8 mp -61.61 -33.75 74.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.189 0.519 . . . . 0.0 110.727 173.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.6 m -68.9 -39.4 79.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.063 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.488 ' HG3' HG22 ' A' ' 23' ' ' ILE . 74.5 mmtt -78.74 -49.81 12.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.876 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.46 83.75 5.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.716 0.769 . . . . 0.0 109.657 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.597 ' HD2' ' HB2' ' A' ' 44' ' ' TYR . 5.2 tmmm? -148.9 129.37 13.9 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.525 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.953 ' HA ' HD21 ' A' ' 49' ' ' LEU . 6.1 t80 74.51 -35.4 0.3 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 123.892 0.745 . . . . 0.0 110.55 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.8 t -67.5 125.44 26.15 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 172.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.1 t80 64.89 8.93 4.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.666 0.746 . . . . 0.0 109.004 -173.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 37.63 60.95 1.07 Allowed 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.475 -171.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.728 HG12 HD21 ' A' ' 51' ' ' ASN . 12.1 tt -82.02 26.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 -178.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.953 HD21 ' HA ' ' A' ' 44' ' ' TYR . 2.2 mm? -77.64 3.02 14.88 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.183 -173.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -71.14 -18.35 62.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.256 0.55 . . . . 0.0 109.82 176.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.728 HD21 HG12 ' A' ' 48' ' ' ILE . 1.1 p-10 -139.3 74.67 34.89 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.2 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -85.87 8.61 4.44 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.631 2.221 . . . . 0.0 110.757 170.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.67 120.82 61.24 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.476 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.435 ' HB2' HE22 ' A' ' 32' ' ' GLN . 91.4 Cg_endo -96.91 -0.22 1.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.101 2.534 . . . . 0.0 114.158 -176.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 t -75.85 -25.5 56.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.87 0.367 . . . . 0.0 111.151 -173.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.695 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -88.21 2.69 51.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.085 179.216 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.566 ' HB3' HD12 ' A' ' 35' ' ' ILE . 15.9 m-85 -106.31 130.53 54.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.181 -175.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.544 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -113.08 165.57 7.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 168.017 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 101' ' ' PHE . 17.6 tp -118.56 138.38 52.59 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.608 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.4 mm? -98.72 126.55 44.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.792 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.682 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.6 pt-20 -88.81 84.35 6.67 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.621 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 12.7 tt0 -85.77 123.37 31.08 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 119.477 -0.889 . . . . 0.0 108.798 175.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.608 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.01 108.82 25.9 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.738 0.78 . . . . 0.0 110.327 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 78.9 t -77.34 143.76 12.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.558 -173.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.644 ' HB3' ' HZ2' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -133.05 85.25 2.2 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 169.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.586 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 5.2 t70 -82.08 -177.64 6.7 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.626 -173.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.461 ' O ' HG23 ' A' ' 67' ' ' THR . 8.9 t -86.59 76.26 9.58 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 122.355 1.074 . . . . 0.0 111.466 -173.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 18.7 m -68.16 -38.2 81.85 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -73.2 -174.88 1.69 Allowed 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.49 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 40.2 mmtm -142.23 151.43 42.09 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 24.4 ttmm 72.38 -49.89 0.7 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 124.009 0.818 . . . . 0.0 110.667 -173.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -105.65 153.1 22.29 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.625 176.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 10.0 m 68.1 97.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.573 0.545 . . . . 0.0 111.238 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' LYS . 25.7 p -90.07 164.6 27.41 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.959 176.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.586 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 31.3 Cg_exo -58.24 124.79 16.7 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.972 1.781 . . . . 0.0 111.481 177.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.541 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 12.5 mmmm -137.98 145.51 42.03 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.592 -174.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.7 p -123.69 127.85 48.79 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.867 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -109.62 100.67 9.68 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.56 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.8 tt0 -95.05 131.27 41.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -134.35 129.89 36.13 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.576 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -85.86 136.47 22.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.269 -173.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.559 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 22.3 mt -93.63 151.8 19.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.501 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.482 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 7.1 mp -80.2 167.03 20.83 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 163.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -54.63 -31.86 57.99 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.495 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 2.3 pt20 -122.13 39.84 3.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.559 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 8.1 mm-40 -76.92 -7.51 55.69 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.262 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.706 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 12.7 t 70.21 130.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 0.0 111.333 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.627 ' H ' ' HA ' ' A' ' 30' ' ' THR . 93.8 t -78.58 -46.89 24.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 CA-C-O 121.344 0.592 . . . . 0.0 109.768 178.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -72.55 -41.37 65.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.557 -175.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.706 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 8.2 mm-40 -63.65 -43.61 96.25 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.345 175.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.88 -49.3 77.18 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.866 0.365 . . . . 0.0 110.436 175.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -57.64 -35.39 70.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.291 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -78.42 -5.96 53.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.012 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.706 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 73.1 mmtt -95.5 -12.64 25.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.227 0.536 . . . . 0.0 110.368 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.454 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 27.2 m0 -57.28 140.21 50.62 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -169.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.608 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.7 mppt? -102.23 38.9 1.58 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.766 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 155.12 -175.5 33.09 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.93 -177.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.557 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.43 108.76 21.31 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.985 0.392 . . . . 0.0 110.168 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -113.46 -150.32 10.54 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.425 -177.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.453 ' HB2' ' HE2' ' A' ' 100' ' ' LYS . 27.8 mtmm -150.25 139.29 21.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -177.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.635 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 97.9 m-85 -83.23 146.49 28.55 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.753 -0.779 . . . . 0.0 108.971 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.608 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 80.1 mt -136.23 127.23 42.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 O-C-N 122.182 -0.324 . . . . 0.0 111.376 -172.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.522 ' HG ' HD13 ' A' ' 35' ' ' ILE . 4.7 mp -79.28 109.8 13.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.16 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.519 ' HG2' HG23 ' A' ' 109' ' ' VAL . 33.6 ttpt -139.67 136.93 34.78 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 176.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.56 HD21 ' CE1' ' A' ' 57' ' ' TYR . 18.5 mt -69.17 142.64 54.26 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.461 0.648 . . . . 0.0 112.507 -171.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.4 ptmm? -69.75 -30.98 68.7 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.427 -1.261 . . . . 0.0 110.084 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.421 ' OE1' ' HG3' ' A' ' 106' ' ' LYS . 5.0 mm-40 -68.16 -19.05 64.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.132 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -109.93 -10.6 14.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.539 178.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.571 HG11 HG11 ' A' ' 81' ' ' VAL . 0.9 OUTLIER -92.56 -33.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.125 -179.413 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 10.9 mm-40 -56.66 85.4 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.319 0 O-C-N 123.836 0.71 . . . . 0.0 112.831 -172.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.98 1.52 6.57 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.056 -0.975 . . . . 0.0 108.559 170.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.1 m -88.48 78.32 7.89 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.145 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.55 ' HB2' ' OE1' ' A' ' 114' ' ' GLU . 43.3 mtm180 -85.56 -59.74 2.23 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 173.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.55 ' OE1' ' HB2' ' A' ' 113' ' ' ARG . 4.1 mp0 -68.74 -48.61 63.33 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.266 -1.334 . . . . 0.0 109.797 175.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -70.86 151.48 44.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.828 174.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.511 ' HA ' ' HE3' ' A' ' 116' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.011 -176.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.626 0.251 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 p -167.54 174.92 7.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.49 -174.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -72.88 -33.6 66.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 176.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -84.49 137.45 33.34 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 170.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 36.8 tt0 -102.81 139.17 38.74 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m -104.2 148.29 26.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.664 0.745 . . . . 0.0 111.755 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.863 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 16.5 p90 -115.78 149.84 37.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.598 -1.183 . . . . 0.0 107.896 176.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -82.73 119.8 24.78 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.563 -173.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.609 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.7 t -108.72 130.98 60.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.652 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.456 ' HG2' HG22 ' A' ' 22' ' ' VAL . 45.9 mt-30 -104.15 109.01 20.65 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 164.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.637 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.5 p -129.23 121.65 54.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.066 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.613 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 91.1 m-70 -71.45 150.6 44.76 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.039 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -96.79 -164.95 1.2 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.074 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.4 p -118.13 10.66 7.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 122.11 0.957 . . . . 0.0 108.79 173.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -108.06 153.41 41.78 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.631 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -85.68 -175.38 1.88 Allowed 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.677 2.251 . . . . 0.0 112.59 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 72.93 -56.67 0.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.812 0.845 . . . . 0.0 110.542 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -123.52 87.4 52.12 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 172.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -83.12 9.13 4.22 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 123.112 2.541 . . . . 0.0 112.841 -174.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.577 ' HA ' ' HA ' ' A' ' 12' ' ' HIS . 64.6 tp -143.47 124.98 14.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.738 0.304 . . . . 0.0 110.823 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.5 m -94.81 124.89 39.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.528 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.456 HG22 ' HG2' ' A' ' 10' ' ' GLN . 46.8 t -102.86 112.92 38.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 171.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.609 HG13 ' HB ' ' A' ' 9' ' ' VAL . 3.1 pt -128.3 168.25 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.132 0.492 . . . . 0.0 111.626 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -117.85 96.98 5.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.732 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -100.69 157.65 33.33 Favored Pre-proline 0 CA--C 1.499 -0.998 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.736 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.9 Cg_exo -63.7 140.48 74.67 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 121.587 1.525 . . . . 0.0 111.436 -174.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.863 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 59.4 mtp180 -62.88 -0.74 0.72 Allowed 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 121.296 0.569 . . . . 0.0 110.421 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' A' ' 26' ' ' PRO . 32.9 m -114.57 -7.16 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.763 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.736 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -59.48 135.07 57.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.124 0.487 . . . . 0.0 110.707 177.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 87' ' ' CYS . 9.7 p -99.62 -168.29 1.58 Allowed 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.453 ' HA ' ' CG1' ' A' ' 88' ' ' VAL . . . -60.54 -50.28 74.19 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.922 -176.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.653 ' HG2' ' HB2' ' A' ' 84' ' ' ASP . 0.1 OUTLIER -59.03 -30.97 68.42 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.736 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -73.75 -52.89 11.68 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.931 0.872 . . . . 0.0 109.824 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.427 HG11 HG11 ' A' ' 88' ' ' VAL . 6.8 p -66.11 -28.14 42.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.679 -1.6 . . . . 0.0 110.3 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.499 HD13 ' HG ' ' A' ' 103' ' ' LEU . 2.3 mm -55.87 -56.21 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.389 171.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.589 ' HG2' ' HG3' ' A' ' 54' ' ' PRO . 40.9 mt-30 -64.33 -32.22 73.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.183 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.732 HE22 ' HA ' ' A' ' 25' ' ' ALA . 7.6 tt0 -61.27 -39.02 88.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.049 179.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.3 m -67.88 -38.81 83.49 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.977 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -55.56 -38.6 69.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.639 174.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.64 -45.62 89.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.133 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -70.8 -35.65 72.63 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.787 0.327 . . . . 0.0 110.942 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.48 12.86 2.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.683 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.413 ' HA ' HD11 ' A' ' 49' ' ' LEU . 7.8 ttpm? -69.88 120.88 16.29 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.745 ' HA ' HD21 ' A' ' 49' ' ' LEU . 89.0 m-85 62.77 -126.66 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 O-C-N 123.843 0.714 . . . . 0.0 109.297 -169.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.7 m 64.83 -87.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.017 0.527 . . . . 0.0 111.517 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -112.05 19.56 17.71 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.631 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 17.6 p 51.46 78.58 0.11 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.463 -176.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.529 HG22 ' O ' ' A' ' 48' ' ' ILE . 4.2 mp -94.75 14.45 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.348 174.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.745 HD21 ' HA ' ' A' ' 44' ' ' TYR . 1.4 mm? -78.82 7.25 7.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.231 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t -71.08 -29.59 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.102 177.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -139.9 79.31 23.23 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.081 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -81.52 0.23 10.04 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.062 2.508 . . . . 0.0 112.096 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -98.18 121.08 58.24 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.607 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.589 ' HG3' ' HG2' ' A' ' 36' ' ' GLN . 86.3 Cg_endo -82.04 -5.93 12.15 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.049 2.499 . . . . 0.0 113.338 -171.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.0 m -65.31 -12.71 54.6 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.053 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 27.2 m-20 -98.68 8.74 44.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.282 0.563 . . . . 0.0 110.35 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.565 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 42.1 m-85 -118.02 139.01 51.81 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.168 -174.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.718 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -104.99 178.9 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 162.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.582 ' HB3' HD12 ' A' ' 82' ' ' LEU . 21.0 tp -134.83 145.71 48.58 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.696 ' O ' ' HA ' ' A' ' 101' ' ' PHE . 2.6 mm? -102.05 126.92 49.11 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.622 ' HG2' ' HB3' ' A' ' 80' ' ' ARG . 11.2 pt-20 -92.32 83.75 5.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.491 1.139 . . . . 0.0 108.202 169.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.627 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -86.7 125.42 33.87 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.501 -0.75 . . . . 0.0 110.082 176.478 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.601 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.9 OUTLIER -117.54 111.33 34.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.28 0.562 . . . . 0.0 110.364 175.176 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.556 HG23 ' OE2' ' A' ' 62' ' ' GLU . 88.9 t -72.29 104.31 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.577 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -85.05 84.5 7.69 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 170.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -73.06 151.4 41.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.289 -172.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.461 HG21 ' HB ' ' A' ' 73' ' ' THR . 0.2 OUTLIER -71.02 -14.98 62.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.407 -175.113 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.5 m 60.07 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.594 0.758 . . . . 0.0 112.673 172.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -35.53 80.36 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.433 0.635 . . . . 0.0 110.153 -177.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -104.15 86.22 2.52 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.068 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.816 ' HA ' ' HE2' ' A' ' 71' ' ' LYS . 8.2 mmpt? -74.01 -19.6 60.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.026 0.441 . . . . 0.0 110.705 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.4 t -79.57 -4.27 50.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.252 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.461 ' HB ' HG21 ' A' ' 67' ' ' THR . 23.0 m -112.73 125.62 54.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.548 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.452 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 36.2 p -50.43 136.5 23.8 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.851 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 13.8 Cg_exo -68.09 165.15 29.34 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 123.03 2.487 . . . . 0.0 111.407 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmm -116.29 95.64 5.17 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.465 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.52 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 15.0 m -83.61 106.6 15.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.455 0.645 . . . . 0.0 110.613 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -89.85 99.87 12.8 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.483 177.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.598 ' HG3' ' HB2' ' A' ' 62' ' ' GLU . 7.0 tt0 -94.36 131.57 39.87 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.622 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 50.2 ttt180 -127.44 149.73 49.96 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.792 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -111.86 135.07 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 118.959 0.799 . . . . 0.0 111.498 -175.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.582 HD12 ' HB3' ' A' ' 59' ' ' LEU . 35.2 mt -89.99 -161.58 0.8 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.802 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.464 ' HB3' ' OE2' ' A' ' 86' ' ' GLU . 37.0 tp -131.93 -51.68 0.97 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.839 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.653 ' HB2' ' HG2' ' A' ' 32' ' ' GLN . 17.7 p-10 177.34 -38.36 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.41 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.426 ' HG3' ' CG ' ' A' ' 84' ' ' ASP . 40.9 mt-30 -118.3 19.22 13.52 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -174.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.464 ' OE2' ' HB3' ' A' ' 83' ' ' LEU . 9.0 mp0 -62.69 -6.63 3.76 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -177.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.474 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 90.4 m 67.84 96.26 0.06 Allowed 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.531 0.52 . . . . 0.0 110.018 -176.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 31' ' ' ALA . 17.9 m -68.92 -27.21 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.282 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -71.42 -39.25 71.19 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.137 -1.025 . . . . 0.0 108.991 176.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 39.2 mm-40 -68.05 -43.33 78.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.576 176.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.7 79.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.455 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.9 -30.89 69.33 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.089 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.3 t -77.67 -19.67 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.514 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 31.5 mmtp -75.23 -23.86 57.61 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.956 0.407 . . . . 0.0 110.367 177.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.3 m0 -58.92 158.34 8.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -171.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.425 ' H ' HG21 ' A' ' 63' ' ' VAL . 11.6 mptt -131.03 23.13 4.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 113.815 -1.539 . . . . 0.0 109.376 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -169.04 174.29 43.54 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -93.77 98.33 11.02 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 117.458 0.629 . . . . 0.0 110.99 -177.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.645 ' O ' ' HG3' ' A' ' 100' ' ' LYS . . . -106.53 -152.54 19.46 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.784 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 10.1 mtmm -156.39 149.63 24.35 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.696 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 94.4 m-85 -82.9 151.02 26.14 Favored 'General case' 0 C--N 1.312 -1.03 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.163 169.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.521 HG13 ' HB2' ' A' ' 12' ' ' HIS . 4.4 mp -130.58 125.56 59.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 121.959 -0.463 . . . . 0.0 110.62 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.499 ' HG ' HD13 ' A' ' 35' ' ' ILE . 1.9 mp -71.05 131.2 43.28 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -154.99 170.15 22.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.3 mp -96.15 145.18 25.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.493 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.718 ' HB3' HG13 ' A' ' 58' ' ' VAL . 15.7 ptpt -82.3 -12.52 57.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.935 0.874 . . . . 0.0 110.043 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -89.95 -2.08 58.09 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.062 170.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -108.15 -41.19 4.98 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.792 HG11 HG11 ' A' ' 81' ' ' VAL . 55.1 t -91.94 105.97 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.574 170.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.678 ' HG3' ' HB3' ' A' ' 112' ' ' SER . 2.7 pt20 -145.4 -176.91 5.3 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.584 -174.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -81.07 66.82 6.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.678 ' HB3' ' HG3' ' A' ' 110' ' ' GLN . 83.8 p -105.26 -168.53 1.48 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.492 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.562 ' HA ' ' CZ ' ' A' ' 113' ' ' ARG . 0.6 OUTLIER -99.09 71.14 1.82 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.636 ' HG2' ' H ' ' A' ' 116' ' ' LYS . 0.0 OUTLIER -110.25 -31.48 7.3 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.243 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 63.15 26.18 15.18 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.42 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.636 ' H ' ' HG2' ' A' ' 114' ' ' GLU . 57.6 tttm . . . . . 0 C--O 1.235 0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.253 178.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.796 0.331 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 m -88.82 82.5 6.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -131.85 4.29 4.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.283 -173.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -120.1 124.67 46.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.116 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.832 ' HG2' ' HD3' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -102.53 121.33 42.14 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.27 177.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 p -99.89 140.79 33.6 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.626 -173.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.862 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.0 p90 -105.91 154.73 20.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -84.9 128.67 34.72 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.162 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.498 HG22 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -122.17 128.89 75.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.072 175.005 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.463 ' HB3' HD22 ' A' ' 20' ' ' LEU . 47.1 mt-30 -100.65 106.01 17.43 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 165.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.658 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -115.69 112.49 39.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.301 -169.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.452 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 21.5 m-70 -62.11 139.88 58.43 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.156 0.503 . . . . 0.0 112.169 -173.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 46' ' ' TYR . 18.1 t70 -86.67 169.73 12.43 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 165.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.462 ' HB ' ' CD2' ' A' ' 46' ' ' TYR . 16.9 t -81.89 -23.89 9.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.549 -178.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.729 ' HB3' ' HD1' ' A' ' 46' ' ' TYR . 79.0 p -92.44 142.01 25.44 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.821 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.4 -9.55 26.3 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.453 2.102 . . . . 0.0 111.764 173.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -60.44 -33.59 72.76 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 174.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -123.88 92.98 47.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.419 170.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -62.42 -18.26 62.09 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.156 2.571 . . . . 0.0 112.737 -175.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.561 HD11 ' HD3' ' A' ' 100' ' ' LYS . 5.7 mt -163.88 125.24 2.31 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.376 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.438 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 18.8 m -93.52 108.56 20.24 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.424 175.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.5 p -92.51 119.61 40.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.438 0.637 . . . . 0.0 110.569 -175.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 24.5 pt -128.78 144.13 39.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.345 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -98.32 95.39 7.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 170.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.63 165.17 14.21 Favored Pre-proline 0 CA--C 1.506 -0.744 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.701 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.643 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 6.1 Cg_exo -68.65 139.89 45.57 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 C-N-CA 122.015 1.81 . . . . 0.0 112.129 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.862 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.8 mtp180 -61.76 -8.66 5.03 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.1 m -99.09 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.604 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.643 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 15.9 m -60.87 120.43 10.15 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.433 0.635 . . . . 0.0 111.5 174.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.524 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -100.0 179.07 4.61 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.35 174.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.624 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.2 -52.44 20.88 Favored 'General case' 0 C--O 1.216 -0.684 0 O-C-N 123.592 0.557 . . . . 0.0 111.697 -170.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.801 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -63.86 -31.88 73.21 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -177.323 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.78 -50.34 21.05 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.8 0.81 . . . . 0.0 109.678 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.636 HG11 HD22 ' A' ' 59' ' ' LEU . 1.4 p -66.6 -27.9 41.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.442 179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 31' ' ' ALA . 5.6 mm -56.23 -57.55 8.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.078 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.554 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 41.8 tt0 -67.26 -35.1 78.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -178.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -59.47 -43.6 93.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 120.892 0.377 . . . . 0.0 110.657 175.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.3 m -71.16 -31.63 67.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.046 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 4.8 mp -55.91 -39.61 71.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.198 0.523 . . . . 0.0 110.384 171.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 62.3 m -72.61 -29.7 63.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.012 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -75.08 -41.1 59.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.401 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.09 44.99 0.8 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.375 0.607 . . . . 0.0 110.509 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.527 ' O ' HD11 ' A' ' 49' ' ' LEU . 6.9 ttpm? -61.94 -30.57 71.0 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.14 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -148.99 0.85 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 m -52.8 -81.43 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.767 0.318 . . . . 0.0 111.725 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.729 ' HD1' ' HB3' ' A' ' 15' ' ' SER . 70.2 t80 -90.88 19.45 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.9 p 48.73 55.32 9.3 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.65 -171.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mt -75.83 71.07 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 122.717 1.246 . . . . 0.0 108.44 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.527 HD11 ' O ' ' A' ' 43' ' ' LYS . 14.4 mt -124.41 -28.68 3.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.164 -1.835 . . . . 0.0 108.42 -176.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -76.79 123.08 25.68 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 163.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 65.66 68.69 0.66 Allowed Pre-proline 0 N--CA 1.467 0.419 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -168.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -85.45 9.25 4.18 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.084 2.523 . . . . 0.0 111.213 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -97.83 124.57 47.52 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.928 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.801 ' HB2' HE22 ' A' ' 32' ' ' GLN . 66.8 Cg_endo -74.71 -10.53 21.75 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.793 2.329 . . . . 0.0 113.19 -173.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.567 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 70.1 m -85.69 8.77 18.42 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -175.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 79.1 m-20 -109.42 -2.15 17.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.305 0.574 . . . . 0.0 109.701 169.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.588 ' HB3' HD12 ' A' ' 35' ' ' ILE . 33.4 m-85 -108.26 154.97 21.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.753 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.72 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.25 155.6 37.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 169.439 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.636 HD22 HG11 ' A' ' 34' ' ' VAL . 22.8 tp -103.1 146.75 27.91 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.991 0.425 . . . . 0.0 110.009 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' A' ' 81' ' ' VAL . 2.1 mm? -106.81 125.45 51.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.881 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.651 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.6 pt-20 -87.76 82.67 7.29 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.3 1.048 . . . . 0.0 108.271 170.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.552 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -87.4 123.55 32.47 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 121.555 -0.716 . . . . 0.0 109.7 176.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.736 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.3 OUTLIER -119.39 118.11 56.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.107 178.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.587 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 63.3 t -79.93 109.79 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.396 177.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -91.19 92.55 8.71 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 172.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -71.06 152.71 43.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.501 -174.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.479 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.0 t -119.79 149.05 42.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.09 -175.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 m -76.48 -5.82 49.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.43 0.633 . . . . 0.0 110.417 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -78.26 0.75 24.05 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.896 -177.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 67' ' ' THR . 37.1 mtmm -52.65 98.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -170.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -148.28 -61.59 0.25 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 m -111.24 -27.42 8.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.741 -1.118 . . . . 0.0 108.464 170.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.4 m -84.02 121.58 27.59 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.394 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 21.5 p -90.61 159.35 41.21 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.93 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.38 147.53 56.36 Favored 'Trans proline' 0 CA--C 1.507 -0.855 0 C-N-CA 122.907 2.405 . . . . 0.0 112.107 176.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.656 ' HE2' ' HA ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -113.43 100.32 8.44 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 113.852 -1.522 . . . . 0.0 111.516 -164.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.587 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 13.4 p -72.79 129.34 37.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.75 176.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.8 m -111.21 107.25 16.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.538 ' HG2' HD12 ' A' ' 60' ' ' LEU . 7.0 tt0 -93.8 131.03 39.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.88 0.371 . . . . 0.0 110.18 -172.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.519 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 55.2 ttt180 -128.01 151.62 48.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.827 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -106.18 144.28 15.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.99 -178.584 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.632 HD21 ' HB3' ' A' ' 61' ' ' GLU . 22.4 mt -101.71 150.88 22.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.566 -175.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 2.8 mm? -88.72 -173.49 4.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.151 170.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.23 -50.69 70.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 111.238 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -116.14 40.12 2.92 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.645 -177.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.463 ' HB2' ' H ' ' A' ' 83' ' ' LEU . 30.2 tp10 -76.1 -11.37 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 175.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 67.1 m 65.0 126.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 114.6 -1.182 . . . . 0.0 112.623 172.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.524 ' H ' ' HA ' ' A' ' 30' ' ' THR . 64.6 t -76.03 -42.26 38.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.559 -174.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -72.26 -38.61 68.8 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.635 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -62.06 -42.1 98.84 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.87 174.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.529 ' HA ' ' CE ' ' A' ' 94' ' ' LYS . . . -60.5 -43.95 96.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.638 176.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -61.17 -31.75 71.49 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.546 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.1 t -77.12 -13.84 59.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.111 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 90' ' ' GLN . 64.4 mttt -85.1 -18.27 34.78 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.493 0.663 . . . . 0.0 110.285 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.503 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.9 m0 -62.32 145.79 52.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.355 -170.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.736 ' H ' HG21 ' A' ' 63' ' ' VAL . 20.5 mttp -115.41 23.8 12.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.754 -1.566 . . . . 0.0 108.169 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 175.89 -171.44 44.49 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-N 114.072 -1.422 . . . . 0.0 110.227 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.11 108.56 20.01 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 117.304 0.552 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.572 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -114.85 -151.02 10.05 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.829 -177.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.561 ' HD3' HD11 ' A' ' 20' ' ' LEU . 1.1 mtmp? -150.46 149.56 30.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.658 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -91.2 124.08 35.14 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.874 168.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.0 mp -111.5 129.44 66.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.304 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.567 ' HG ' HD13 ' A' ' 35' ' ' ILE . 3.8 mp -77.98 131.08 37.24 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.892 175.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.559 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 19.0 ttmm -145.87 -177.1 5.41 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 4.7 mp -106.57 135.71 47.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.92 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.72 ' HB3' HG13 ' A' ' 58' ' ' VAL . 16.5 ptmt -69.92 -31.88 69.88 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.344 -177.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.6 ' HA ' ' HG2' ' A' ' 110' ' ' GLN . 12.0 pt-20 -74.7 -15.77 60.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -95.49 -23.9 16.9 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.827 HG11 HG11 ' A' ' 81' ' ' VAL . 55.8 t -86.31 8.72 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.519 175.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.6 ' HG2' ' HA ' ' A' ' 107' ' ' GLU . 28.2 mm-40 -75.95 51.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 171.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.88 -10.24 59.26 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.453 -176.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 32.6 m -128.0 -35.5 2.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.93 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.581 ' O ' ' HB3' ' A' ' 110' ' ' GLN . 36.0 ttt180 -103.2 109.11 20.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.091 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -98.52 -72.71 0.64 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.419 ' CG ' ' H ' ' A' ' 116' ' ' LYS . 8.0 t70 -175.73 -159.51 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.419 ' H ' ' CG ' ' A' ' 115' ' ' ASP . 38.4 pttt . . . . . 0 C--N 1.324 -0.532 0 CA-C-O 120.578 0.228 . . . . 0.0 110.979 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 121.126 0.489 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.5 t -179.54 77.78 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -93.02 -11.7 32.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.008 -169.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 1.9 pm0 -84.34 148.41 26.66 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.052 174.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -121.7 117.28 26.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.717 0.77 . . . . 0.0 111.953 -174.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.614 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 7.9 p -123.05 139.75 53.74 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.4 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.771 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 18.0 p90 -107.26 148.3 29.13 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -79.59 131.7 36.08 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.758 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.49 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.9 t -122.81 142.64 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.571 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.427 ' HB3' HD11 ' A' ' 20' ' ' LEU . 46.5 mt-30 -111.56 107.07 16.11 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 167.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.528 ' HB ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -122.63 139.65 48.86 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -175.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.693 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 92.5 m-70 -89.74 121.05 31.54 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.951 177.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.41 172.78 6.63 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 172.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.46 39.19 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 111.372 -170.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.713 ' HA ' ' HB2' ' A' ' 46' ' ' TYR . 36.7 m -115.15 151.8 46.08 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.449 . . . . 0.0 111.159 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.503 ' HD3' ' CD1' ' A' ' 46' ' ' TYR . 89.5 Cg_endo -94.43 -11.85 1.15 Allowed 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.301 2.667 . . . . 0.0 112.892 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.53 -24.79 59.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.001 0.429 . . . . 0.0 110.428 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -149.81 95.47 3.68 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.77 -44.72 38.34 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.607 2.204 . . . . 0.0 111.737 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.427 HD11 ' HB3' ' A' ' 10' ' ' GLN . 64.8 tp -107.53 100.27 9.7 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.26 108.76 7.24 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.489 -179.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.25 123.07 47.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 121.981 -0.449 . . . . 0.0 109.925 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.3 pt -130.36 175.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.147 0.499 . . . . 0.0 110.776 -178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 44.0 tttp -132.06 96.98 4.03 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 171.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.91 158.21 32.23 Favored Pre-proline 0 CA--C 1.5 -0.948 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.527 -176.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.712 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 8.1 Cg_exo -61.59 141.76 92.4 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.93 1.753 . . . . 0.0 111.625 -174.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.771 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.6 mtp-105 -61.79 -2.36 0.82 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.872 0.844 . . . . 0.0 110.235 -179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' A' ' 26' ' ' PRO . 3.4 p -107.67 -21.95 5.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.413 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.712 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 98.8 p -56.18 127.76 32.28 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 120.93 0.395 . . . . 0.0 110.353 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.495 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 7.7 p -95.27 -166.51 1.47 Allowed 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.477 ' HB2' HD13 ' A' ' 82' ' ' LEU . . . -59.26 -50.05 75.5 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.042 -177.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.441 ' NE2' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -60.72 -31.83 71.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 -178.067 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -73.29 -53.16 11.52 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 122.128 0.966 . . . . 0.0 109.797 -176.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.562 HG11 HG11 ' A' ' 88' ' ' VAL . 5.4 p -65.96 -27.96 42.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 113.771 -1.558 . . . . 0.0 110.29 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.548 HD12 ' HB3' ' A' ' 57' ' ' TYR . 4.3 mm -56.42 -56.52 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.134 170.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 34.6 tt0 -69.63 -33.4 72.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.384 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -62.03 -36.11 80.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.012 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.2 m -69.33 -37.3 77.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.899 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 7.4 mp -53.65 -44.21 69.41 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.157 0.503 . . . . 0.0 110.101 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.514 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 48.9 t -63.39 -36.19 82.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.08 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.34 -12.01 58.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.755 0.312 . . . . 0.0 111.56 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.32 17.07 14.76 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' A' ' 40' ' ' CYS . 0.9 OUTLIER -73.46 11.64 0.75 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -178.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.596 ' HA ' ' HA ' ' A' ' 47' ' ' SER . 27.7 p90 -167.38 4.94 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.544 167.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 t -62.0 -68.79 0.29 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.756 0.312 . . . . 0.0 110.473 -175.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.713 ' HB2' ' HA ' ' A' ' 15' ' ' SER . 32.5 t80 -90.95 18.79 6.23 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 167.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.596 ' HA ' ' HA ' ' A' ' 44' ' ' TYR . 12.0 m 58.03 50.49 10.07 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.38 -172.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.419 HD11 ' HD2' ' A' ' 46' ' ' TYR . 39.9 mm -81.51 68.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.534 0.683 . . . . 0.0 109.381 175.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 44' ' ' TYR . 5.7 mp -104.32 -6.5 20.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.481 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.9 m -77.95 -24.48 48.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.612 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -122.47 101.48 40.43 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.358 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -101.47 14.14 0.38 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.406 2.737 . . . . 0.0 113.034 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.519 HD22 ' H ' ' A' ' 53' ' ' ASN . 0.1 OUTLIER -131.16 116.14 16.58 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 122.143 0.973 . . . . 0.0 111.34 -177.44 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.441 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 72.7 Cg_endo -80.06 8.13 4.26 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 123.024 2.483 . . . . 0.0 112.437 -175.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 p -73.17 -3.62 27.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.784 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 m-20 -107.81 -3.38 19.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.36 176.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.548 ' HB3' HD12 ' A' ' 35' ' ' ILE . 35.4 m-85 -103.56 145.82 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.829 -171.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.602 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -135.33 151.98 31.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.608 165.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.824 HD21 ' HB3' ' A' ' 101' ' ' PHE . 32.5 tp -104.51 147.17 27.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.041 0.448 . . . . 0.0 111.274 -174.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.573 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -102.84 124.9 49.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.732 176.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.667 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.5 pt-20 -88.82 87.31 7.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.232 1.015 . . . . 0.0 108.569 170.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.662 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 1.3 tt0 -85.86 124.47 32.37 Favored 'General case' 0 N--CA 1.426 -1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 109.685 175.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.57 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.8 OUTLIER -118.18 113.8 43.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-O 121.188 0.518 . . . . 0.0 110.159 175.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.576 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t -77.78 110.1 13.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.593 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.466 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 8.9 ptpp? -98.91 90.84 4.79 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 171.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -104.6 171.27 7.42 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.731 -175.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.8 t -144.67 117.73 8.87 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.891 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.7 m -88.57 -7.6 56.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.572 0.701 . . . . 0.0 110.063 -175.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -101.75 -59.01 1.77 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 -178.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -82.17 82.65 7.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.206 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 71' ' ' LYS . 1.6 mmmp? -80.99 17.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -174.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.4 t -65.46 -18.94 65.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -134.36 151.22 51.09 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.478 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.5 p -82.0 163.53 52.81 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.931 175.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.99 126.23 21.54 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 121.86 1.707 . . . . 0.0 110.925 174.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -108.92 99.84 9.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.628 -171.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.576 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 8.2 p -73.77 103.34 4.29 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.653 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.7 m -86.51 101.0 12.78 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.525 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.597 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 33.2 tt0 -93.91 129.86 40.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.86 -175.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.474 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 38.5 ttt-85 -125.84 147.38 49.46 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.944 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -101.65 143.24 14.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.362 178.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.563 HD22 ' HB3' ' A' ' 86' ' ' GLU . 45.3 mt -98.57 162.96 12.86 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.609 -176.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.588 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 58.6 mt -84.65 174.68 9.76 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 166.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.428 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 11.3 m-20 -55.05 -44.24 74.55 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.911 0.386 . . . . 0.0 110.546 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -121.35 53.36 1.17 Allowed 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.629 0.252 . . . . 0.0 111.374 176.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.588 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.2 OUTLIER -75.04 -4.29 37.52 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.559 174.283 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.495 ' HA ' ' HB ' ' A' ' 30' ' ' THR . 47.1 m 64.39 105.72 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.179 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.563 HG11 HD23 ' A' ' 59' ' ' LEU . 17.9 m -74.39 -27.37 21.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 O-C-N 122.311 -0.243 . . . . 0.0 111.585 -178.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -70.82 -38.58 73.27 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.459 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -63.65 -48.28 77.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.074 175.604 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.52 -50.51 67.69 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.401 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.502 ' OE1' ' HE2' ' A' ' 7' ' ' PHE . 20.8 tt0 -63.63 -37.18 86.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.707 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.4 p -75.4 -10.36 59.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.532 0.682 . . . . 0.0 110.263 176.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -101.94 -0.43 33.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.646 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.441 ' C ' ' HD3' ' A' ' 96' ' ' LYS . 40.3 m0 -75.62 158.42 32.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 122.131 0.967 . . . . 0.0 112.78 175.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.518 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.8 mppt? -126.94 29.87 5.56 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 113.466 -1.697 . . . . 0.0 109.228 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -175.36 -153.01 9.81 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.887 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -121.22 104.39 9.7 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.825 0.345 . . . . 0.0 110.248 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.662 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -114.56 -154.46 10.9 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.075 -1.059 . . . . 0.0 113.112 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.693 ' HD2' ' NE2' ' A' ' 12' ' ' HIS . 4.8 mtmp? -151.77 137.3 17.75 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.352 0.661 . . . . 0.0 109.76 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.824 ' HB3' HD21 ' A' ' 59' ' ' LEU . 92.3 m-85 -81.21 119.56 23.77 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.878 174.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 58.2 mt -110.26 120.16 60.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 O-C-N 121.993 -0.442 . . . . 0.0 111.122 -172.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.651 HD12 HD13 ' A' ' 59' ' ' LEU . 1.6 mp -71.08 128.55 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.394 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.512 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 18.3 ttmm -144.71 -177.76 5.67 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 175.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.548 ' HB3' ' HG3' ' A' ' 107' ' ' GLU . 38.7 mt -110.05 149.61 29.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.641 0.734 . . . . 0.0 111.852 -179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 19.0 ptmt -87.31 -12.31 46.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.136 -179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.548 ' HG3' ' HB3' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -79.79 -5.89 56.24 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.315 169.5 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.465 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 47.8 mt-30 -107.54 -51.07 2.96 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 173.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.944 HG11 HG11 ' A' ' 81' ' ' VAL . 91.6 t -84.01 90.1 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-N 114.116 -1.402 . . . . 0.0 109.969 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.458 ' C ' ' H ' ' A' ' 112' ' ' SER . 3.8 pt20 -131.16 44.58 2.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.544 -176.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 68.52 -11.66 0.39 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.126 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.458 ' H ' ' C ' ' A' ' 110' ' ' GLN . 92.2 p 57.71 174.86 0.05 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.593 1.157 . . . . 0.0 112.55 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.73 -24.15 11.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -71.16 -30.31 66.29 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.127 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.65 114.6 3.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.971 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.546 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.475 0.781 0 CA-C-O 120.712 0.291 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.452 ' O ' ' HB2' ' A' ' 27' ' ' ARG . 66.6 m -139.59 5.37 2.21 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.133 0.492 . . . . 0.0 111.495 -179.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -86.07 -10.56 54.74 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.632 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -102.09 5.9 40.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.486 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -129.92 147.38 51.67 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.096 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.563 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 9.8 p -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.073 0.463 . . . . 0.0 109.972 176.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.91 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 10.6 p90 -104.75 154.03 20.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -83.95 137.95 33.38 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.65 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.582 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.1 t -128.23 139.52 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.828 0.347 . . . . 0.0 110.265 176.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -107.58 106.29 16.57 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 165.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.69 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -116.45 134.38 60.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.698 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -89.35 146.16 24.87 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.96 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -97.64 -167.3 1.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.8 t -108.01 -15.06 9.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 176.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.421 ' HB3' ' CE2' ' A' ' 46' ' ' TYR . 1.3 m -96.63 151.97 38.27 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.108 -175.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.424 ' O ' ' HB3' ' A' ' 17' ' ' GLU . 8.8 Cg_exo -72.57 -174.98 1.63 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.989 2.459 . . . . 0.0 111.772 175.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.424 ' C ' ' HD3' ' A' ' 19' ' ' PRO . 11.4 tp10 72.77 -42.72 0.54 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.237 0.615 . . . . 0.0 110.559 -176.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -122.92 71.57 42.22 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.391 175.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.424 ' HD3' ' C ' ' A' ' 17' ' ' GLU . 22.8 Cg_exo -64.57 -39.33 28.16 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.307 2.005 . . . . 0.0 110.708 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -120.49 114.14 21.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.022 174.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 m -92.14 109.94 21.31 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.336 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.9 p -91.82 112.74 26.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.782 0.801 . . . . 0.0 110.553 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.414 HG13 ' HB ' ' A' ' 9' ' ' VAL . 6.8 pt -121.17 171.19 10.2 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.741 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 41.5 tttp -129.25 96.12 4.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 172.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.22 161.57 22.5 Favored Pre-proline 0 CA--C 1.507 -0.706 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.324 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.956 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.9 Cg_exo -64.91 143.35 79.15 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 121.779 1.653 . . . . 0.0 111.817 -172.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.91 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 58.5 mtp85 -63.23 -1.68 1.13 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.317 0.579 . . . . 0.0 110.48 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.442 ' H ' ' C ' ' A' ' 26' ' ' PRO . 31.6 m -118.69 -0.88 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.524 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.956 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 84.4 p -59.89 139.09 57.61 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.132 0.491 . . . . 0.0 110.846 175.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.551 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 1.8 t -107.35 179.22 4.31 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.523 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.99 -48.97 61.22 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 123.206 0.316 . . . . 0.0 111.495 -175.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.671 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -59.65 -32.54 70.55 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.539 0.209 . . . . 0.0 110.911 -179.177 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.66 -54.18 9.75 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.059 0.933 . . . . 0.0 109.973 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.566 ' CG1' HD22 ' A' ' 59' ' ' LEU . 9.8 p -64.57 -27.34 42.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.748 -1.569 . . . . 0.0 109.849 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.647 HD13 HD12 ' A' ' 103' ' ' LEU . 6.1 mm -56.97 -56.15 16.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.066 167.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.9 tm0? -67.2 -34.64 77.93 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.791 -175.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -65.53 -48.95 70.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.477 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.456 ' HB ' HD13 ' A' ' 103' ' ' LEU . 20.6 m -63.68 -39.25 93.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.331 0.586 . . . . 0.0 110.14 178.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.45 -43.81 93.1 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.716 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.9 t -62.39 -33.98 75.82 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.734 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -75.33 -43.45 50.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.815 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.859 ' HB1' HD12 ' A' ' 48' ' ' ILE . . . -69.92 -7.12 37.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.444 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.665 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 25.0 ttpp -68.13 -11.32 58.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.101 0.476 . . . . 0.0 109.912 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -140.95 -24.11 0.76 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.388 172.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.676 ' HB3' ' HA ' ' A' ' 42' ' ' ALA . 13.0 t -65.77 115.15 5.6 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.421 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 71.3 t80 66.36 4.14 3.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.945 0.879 . . . . 0.0 108.904 -173.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.437 ' C ' HD12 ' A' ' 49' ' ' LEU . 3.0 m 44.93 69.73 0.41 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 113.899 -1.5 . . . . 0.0 111.679 -173.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.859 HD12 ' HB1' ' A' ' 42' ' ' ALA . 50.7 mt -76.95 -67.57 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.563 173.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' A' ' 43' ' ' LYS . 4.1 mp 67.19 -47.5 0.48 Allowed 'General case' 0 N--CA 1.473 0.695 0 O-C-N 124.022 0.827 . . . . 0.0 112.98 176.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.0 m -53.81 130.66 37.76 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 122.746 0.419 . . . . 0.0 111.469 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 55.72 72.25 1.07 Allowed Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.287 -176.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -84.71 7.61 5.09 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 123.008 2.472 . . . . 0.0 111.535 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.42 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 1.6 p-10 -91.16 116.95 67.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.467 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.671 ' HB2' HE22 ' A' ' 32' ' ' GLN . 84.0 Cg_endo -85.53 2.23 7.81 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.082 2.521 . . . . 0.0 112.941 -171.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.9 p -85.44 -1.75 57.38 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.413 0.625 . . . . 0.0 110.815 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.593 ' C ' ' HG2' ' A' ' 106' ' ' LYS . 4.1 m-20 -120.88 9.88 10.75 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.191 -173.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.672 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 31.7 m-85 -115.17 166.0 12.31 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.96 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.817 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -142.85 171.41 9.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.578 171.432 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.777 HD21 ' HB3' ' A' ' 101' ' ' PHE . 9.7 tp -124.0 145.48 49.17 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.7 mm? -98.78 130.34 45.23 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.631 179.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.604 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.7 pt-20 -95.55 84.92 4.05 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.404 1.097 . . . . 0.0 108.613 170.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.657 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 15.2 tt0 -85.62 124.23 31.93 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 121.465 -0.772 . . . . 0.0 108.961 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.522 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -114.46 110.09 30.8 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.514 HG23 ' HA2' ' A' ' 99' ' ' GLY . 61.3 t -81.57 113.75 21.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.721 -176.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -98.82 59.6 1.22 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.692 0.758 . . . . 0.0 109.353 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.47 133.9 47.26 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.722 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 7.6 t -143.9 128.85 18.49 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.988 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.7 p -129.08 8.77 5.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.501 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -74.44 -51.62 14.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.441 -176.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -73.03 -79.86 0.07 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.608 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.1 pttp 178.16 106.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.473 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.1 m -138.44 126.64 22.87 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.242 -175.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 m -63.93 -52.04 61.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.938 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.446 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 33.2 p -135.37 138.01 27.75 Favored Pre-proline 0 C--O 1.235 0.339 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.883 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 36.6 Cg_exo -61.13 157.66 38.46 Favored 'Trans proline' 0 CA--C 1.519 -0.25 0 C-N-CA 123.177 2.584 . . . . 0.0 112.477 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -113.09 112.0 23.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.482 -174.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.455 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.6 m -96.94 103.7 15.65 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.542 176.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 m -82.23 99.53 9.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.562 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 25.8 tt0 -95.44 131.98 41.01 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 -174.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.478 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 21.7 tpp85 -129.1 159.98 34.28 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.806 HG11 HG11 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -118.21 145.77 23.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 118.442 0.565 . . . . 0.0 111.149 -175.669 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.453 HD12 ' HB3' ' A' ' 59' ' ' LEU . 42.4 mt -101.62 177.22 4.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.918 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' ASP . 30.4 tp -113.98 -49.39 2.86 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.929 0.492 . . . . 0.0 110.408 -175.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LEU . 3.5 p-10 178.46 -45.79 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.664 172.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.509 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 3.0 pt20 -117.35 34.65 5.02 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.0 mp0 -65.73 -14.78 61.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.863 -0.153 . . . . 0.0 111.213 173.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 68.2 m 66.88 104.87 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.558 0 O-C-N 123.795 0.684 . . . . 0.0 110.131 -174.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.551 ' H ' ' HA ' ' A' ' 30' ' ' THR . 15.2 m -74.79 -30.76 24.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -173.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -72.63 -37.86 67.91 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.554 -0.858 . . . . 0.0 108.804 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.685 ' O ' ' HG2' ' A' ' 94' ' ' LYS . 9.0 mm100 -65.02 -43.54 92.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.913 173.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.48 88.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.332 0.587 . . . . 0.0 110.223 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 88' ' ' VAL . 1.7 tt0 -57.94 -42.29 84.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.57 -177.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.5 p -72.84 -12.53 61.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.679 -177.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.685 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 70.0 mmtt -87.25 -16.32 35.56 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.196 0.522 . . . . 0.0 110.823 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 45.4 m0 -60.73 157.9 13.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.438 -176.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.438 ' H ' HG21 ' A' ' 63' ' ' VAL . 25.0 mtmm -129.85 28.3 5.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.725 177.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.486 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -178.22 159.02 24.23 Favored Glycine 0 N--CA 1.442 -0.941 0 CA-C-N 113.802 -1.544 . . . . 0.0 109.644 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.486 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -81.62 106.8 13.86 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 117.504 0.652 . . . . 0.0 110.684 -177.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.657 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -110.47 -151.96 13.05 Favored Glycine 0 N--CA 1.434 -1.471 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.033 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.443 ' HG3' ' C ' ' A' ' 99' ' ' GLY . 8.2 mtmt -149.79 144.2 25.86 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.777 ' HB3' HD21 ' A' ' 59' ' ' LEU . 86.2 m-85 -82.11 152.55 26.5 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.315 169.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.81 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 76.2 mt -138.67 126.4 27.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.176 -0.327 . . . . 0.0 111.072 -174.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.647 HD12 HD13 ' A' ' 35' ' ' ILE . 4.7 tp -75.57 134.63 40.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.56 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 8.4 tppt? -150.52 176.32 11.07 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.672 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.3 tp -103.69 139.19 39.29 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.817 ' HB3' HG13 ' A' ' 58' ' ' VAL . 17.5 ptmt -83.85 -34.21 24.68 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.009 -174.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.504 ' HA ' ' OE1' ' A' ' 110' ' ' GLN . 12.8 pt-20 -70.99 -2.61 15.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.421 0.629 . . . . 0.0 109.919 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.58 ' HG3' ' HB3' ' A' ' 116' ' ' LYS . 8.6 tt0 -106.25 -18.68 13.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.442 176.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.806 HG11 HG11 ' A' ' 81' ' ' VAL . 16.8 t -104.24 -19.04 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.527 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.504 ' OE1' ' HA ' ' A' ' 107' ' ' GLU . 16.1 pt20 -67.11 76.45 0.13 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.257 0.551 . . . . 0.0 111.693 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 68.06 -8.89 0.52 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.031 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.501 ' H ' ' C ' ' A' ' 110' ' ' GLN . 56.5 m 62.12 79.17 0.26 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.429 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.0 mmm180 -84.17 117.61 23.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.072 173.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 67.86 -177.3 0.21 Allowed 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.955 0.784 . . . . 0.0 110.492 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -103.95 132.65 50.0 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.58 ' HB3' ' HG3' ' A' ' 108' ' ' GLN . 55.3 tttp . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.372 -177.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.2 p . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m -90.79 97.1 10.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 170.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -77.63 -21.15 52.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.223 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -94.37 175.44 6.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.221 175.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.694 ' HB2' ' HD3' ' A' ' 27' ' ' ARG . 13.4 pt-20 -102.72 110.42 22.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.847 0.832 . . . . 0.0 109.925 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.467 ' OG ' ' HE3' ' A' ' 24' ' ' LYS . 49.8 p -123.39 145.06 49.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.077 -175.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.809 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.8 p90 -135.15 147.02 49.33 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -85.68 137.06 33.09 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.113 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.522 HG22 ' CE2' ' A' ' 7' ' ' PHE . 1.2 t -123.43 142.65 39.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.078 0.466 . . . . 0.0 110.477 176.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.482 ' HB3' HD11 ' A' ' 20' ' ' LEU . 38.9 mt-30 -110.62 107.38 16.95 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 166.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -123.18 139.11 50.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -177.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.487 ' HB2' HG12 ' A' ' 102' ' ' ILE . 10.5 m-70 -87.82 112.21 22.22 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.736 179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -91.51 171.49 9.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 171.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.9 t -79.58 -18.34 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.773 0.321 . . . . 0.0 110.735 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.77 ' HA ' ' HB2' ' A' ' 46' ' ' TYR . 13.7 m -62.93 138.85 97.32 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-O 121.507 0.67 . . . . 0.0 111.124 179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 15' ' ' SER . 93.4 Cg_endo -87.41 -7.21 6.84 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.546 2.83 . . . . 0.0 112.656 -175.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -73.43 -22.41 60.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.682 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.52 ' HG3' ' HA ' ' A' ' 21' ' ' THR . 6.7 tp-100 -154.23 89.54 3.32 Favored Pre-proline 0 C--N 1.32 -0.674 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HD2' ' HA ' ' A' ' 18' ' ' GLN . 7.0 Cg_endo -48.82 -63.58 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.322 2.681 . . . . 0.0 111.539 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 10' ' ' GLN . 65.4 tp -90.15 93.36 9.34 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.52 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.3 m -70.33 109.2 4.58 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.666 -177.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.0 121.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 pt -129.71 164.3 32.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.745 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' ' OG ' ' A' ' 6' ' ' SER . 28.7 tttp -118.14 105.27 11.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB1' ' HD2' ' A' ' 26' ' ' PRO . . . -112.03 169.24 6.55 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.22 -174.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.724 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.3 Cg_endo -75.43 141.02 24.97 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 122.147 1.898 . . . . 0.0 111.993 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.809 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 39.7 mtp-105 -61.8 -6.17 2.5 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 122.147 0.975 . . . . 0.0 110.166 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.437 ' CG1' ' HB2' ' A' ' 26' ' ' PRO . 3.0 p -103.97 -20.52 5.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.194 -178.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.724 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 95.1 p -58.04 126.59 28.13 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 120.851 0.357 . . . . 0.0 110.08 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.443 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 28.4 p -94.78 -164.78 1.21 Allowed 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.529 ' HB2' HD13 ' A' ' 82' ' ' LEU . . . -61.94 -50.18 73.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.83 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.557 ' NE2' ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -59.59 -33.95 72.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.102 0.477 . . . . 0.0 110.48 -179.196 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -69.26 -53.26 20.75 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 122.163 0.982 . . . . 0.0 109.599 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.461 ' CG1' HD22 ' A' ' 59' ' ' LEU . 5.6 p -68.84 -28.24 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 CA-C-N 113.352 -1.749 . . . . 0.0 110.357 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.705 HD13 ' HG ' ' A' ' 103' ' ' LEU . 3.8 mm -57.16 -57.77 8.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.366 171.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.571 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 33.2 tt0 -68.06 -33.61 74.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.003 -175.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -59.29 -42.64 91.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.2 m -70.14 -37.04 75.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.917 176.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 3.5 mp -52.59 -47.45 66.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.327 0.584 . . . . 0.0 110.59 172.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.549 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 16.1 t -69.97 -29.28 66.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.212 -176.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -81.88 -30.19 32.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 44' ' ' TYR . . . -103.65 18.02 22.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.808 -176.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 40' ' ' CYS . 18.5 pttp -71.05 30.84 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.651 ' HA ' HD11 ' A' ' 49' ' ' LEU . 15.3 p90 179.12 -20.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.036 0.534 . . . . 0.0 109.972 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.6 t -60.82 -69.51 0.23 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.911 -176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.77 ' HB2' ' HA ' ' A' ' 15' ' ' SER . 74.1 t80 -85.1 9.26 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 167.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 44' ' ' TYR . 13.1 m 62.54 54.39 2.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 113.852 -1.522 . . . . 0.0 110.395 -173.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.0 mm -81.1 62.76 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 122.03 0.919 . . . . 0.0 109.207 174.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.651 HD11 ' HA ' ' A' ' 44' ' ' TYR . 5.1 mp -105.66 -24.03 12.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.287 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.6 m -64.34 -36.65 84.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.774 -176.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -123.27 97.89 42.28 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -87.5 -14.09 3.93 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.488 2.125 . . . . 0.0 113.617 -176.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.495 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -96.46 132.16 27.01 Favored Pre-proline 0 N--CA 1.454 -0.241 0 CA-C-O 121.745 0.783 . . . . 0.0 110.986 -176.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 86.9 Cg_endo -91.72 3.57 4.09 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.833 2.355 . . . . 0.0 112.745 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.634 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 19.2 m -75.73 -10.09 59.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.217 -177.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 11.7 m-20 -99.19 -1.52 39.06 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.972 0.415 . . . . 0.0 110.265 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.56 ' HB3' HD12 ' A' ' 35' ' ' ILE . 50.6 m-85 -101.54 145.1 29.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.653 -174.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -131.63 144.16 38.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.888 165.649 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.808 HD21 ' HB3' ' A' ' 101' ' ' PHE . 18.4 tp -97.03 142.56 28.82 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.407 -177.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.541 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.4 mm? -98.44 129.62 45.06 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 176.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.657 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 12.4 pt-20 -93.25 87.76 5.78 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 170.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.5 tt0 -85.61 125.04 32.82 Favored 'General case' 0 N--CA 1.425 -1.694 0 O-C-N 121.045 -1.034 . . . . 0.0 109.783 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.652 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.7 OUTLIER -117.82 112.65 39.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.322 0.582 . . . . 0.0 110.468 175.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.505 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.7 t -76.44 105.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.437 176.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -115.82 87.33 2.65 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 122.038 0.923 . . . . 0.0 108.994 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -94.93 174.4 7.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.93 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.8 t -110.83 104.19 12.79 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 121.749 0.785 . . . . 0.0 108.988 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.9 m -83.09 -28.95 29.13 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.257 -177.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -69.28 -57.34 5.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.989 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -96.27 132.44 41.74 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.905 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.41 ' HD2' ' HA ' ' A' ' 71' ' ' LYS . 5.9 mmmp? -120.9 33.5 5.54 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.8 t -78.79 -22.72 45.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.148 0.499 . . . . 0.0 109.829 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 t -123.8 -179.02 4.22 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.684 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 39.1 p -105.16 156.88 35.46 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.609 0.242 . . . . 0.0 111.045 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -55.76 132.54 52.68 Favored 'Trans proline' 0 CA--C 1.516 -0.395 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -125.18 134.44 52.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.75 0.786 . . . . 0.0 112.128 -172.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 54.4 p -92.61 118.55 31.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.7 m -94.04 101.76 13.81 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.633 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.27 131.47 39.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.72 -175.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.506 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 33.8 ttt180 -124.63 153.85 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.861 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -109.26 130.17 62.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.552 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 31' ' ' ALA . 21.2 mt -85.83 165.65 16.67 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.515 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.509 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 75.0 mt -84.39 178.93 7.56 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 166.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 33.5 m-20 -55.22 -48.33 74.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.191 0.519 . . . . 0.0 110.058 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -121.69 50.78 1.38 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.121 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.509 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -71.82 -3.96 25.19 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 174.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 32.6 m 66.11 104.69 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.188 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.447 HG13 ' CA ' ' A' ' 31' ' ' ALA . 23.6 m -74.45 -26.25 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.508 0 O-C-N 122.228 -0.295 . . . . 0.0 111.641 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -71.97 -35.18 69.44 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.501 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -66.32 -48.15 71.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.199 175.123 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.411 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -54.4 -48.83 71.14 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.969 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -56.94 -47.94 79.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.46 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.6 p -70.61 -6.67 38.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.448 0.642 . . . . 0.0 110.839 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 25.9 ttpp -106.66 0.25 24.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.106 -176.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.464 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -74.22 157.39 35.97 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.754 0.787 . . . . 0.0 112.906 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.652 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.6 mppt? -120.65 23.78 10.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.22 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 176.28 -175.06 47.36 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.344 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -99.46 104.99 16.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 117.386 0.593 . . . . 0.0 111.092 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.625 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -111.56 -145.98 10.22 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.42 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.37 145.46 13.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.225 0.61 . . . . 0.0 109.636 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.808 ' HB3' HD21 ' A' ' 59' ' ' LEU . 93.4 m-85 -79.96 140.8 36.49 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.991 175.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.487 HG12 ' HB2' ' A' ' 12' ' ' HIS . 70.0 mt -129.03 125.69 63.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 122.187 -0.321 . . . . 0.0 111.246 -173.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.705 ' HG ' HD13 ' A' ' 35' ' ' ILE . 6.4 mp -73.86 128.35 35.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.023 0.439 . . . . 0.0 111.219 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.508 ' HG2' ' H ' ' A' ' 105' ' ' LEU . 21.1 ttmm -145.72 177.87 8.57 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 57' ' ' TYR . 18.1 mt -108.87 143.41 38.12 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.374 0.607 . . . . 0.0 112.041 179.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.634 ' HD3' ' O ' ' A' ' 55' ' ' SER . 18.9 ptmt -83.56 -16.55 44.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.326 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -73.27 -13.31 61.11 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.741 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -105.55 -43.53 4.92 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.861 HG11 HG11 ' A' ' 81' ' ' VAL . 80.1 t -78.33 77.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.206 170.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.423 ' C ' ' H ' ' A' ' 112' ' ' SER . 2.8 pt20 -111.47 32.8 5.11 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.116 -171.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . 72.7 -19.23 0.31 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.497 0.719 . . . . 0.0 112.55 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.423 ' H ' ' C ' ' A' ' 110' ' ' GLN . 85.1 p 61.13 136.64 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.968 1.307 . . . . 0.0 112.865 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -25.18 59.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.652 -179.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -91.86 20.26 5.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.46 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -64.63 111.19 2.62 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.665 ' HE2' ' HA ' ' A' ' 116' ' ' LYS . 10.6 mmpt? . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.355 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 p -93.66 126.44 38.83 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.154 -0.314 . . . . 0.0 110.154 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -83.33 -23.03 32.72 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.945 0.403 . . . . 0.0 109.93 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -68.94 141.91 54.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.283 176.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.526 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 35.6 tt0 -102.16 124.34 47.58 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.597 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.4 140.49 31.77 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.078 0.466 . . . . 0.0 110.415 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.624 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 3.4 p90 -106.13 155.78 19.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -176.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -90.88 137.01 32.69 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.255 -174.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.603 ' HB ' HG13 ' A' ' 23' ' ' ILE . 5.2 t -122.49 141.0 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.625 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.579 ' HB3' HD11 ' A' ' 20' ' ' LEU . 45.8 mt-30 -111.43 109.24 19.11 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 165.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.73 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 1.4 p -135.83 137.9 48.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.776 0.322 . . . . 0.0 111.131 -173.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 -97.92 170.04 9.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 111.195 -177.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -143.93 -176.82 5.14 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 170.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.02 -22.66 6.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.412 0.625 . . . . 0.0 109.317 175.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.0 t -64.59 132.98 95.56 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.778 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.77 ' HD2' ' HB2' ' A' ' 46' ' ' TYR . 77.7 Cg_endo -78.11 -173.95 2.04 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 123.227 2.618 . . . . 0.0 112.524 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 67.81 96.64 0.06 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.786 -175.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.58 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 10.6 mm-40 67.69 81.99 0.2 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.53 -172.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.18 -45.4 27.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.146 2.564 . . . . 0.0 112.671 -177.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.579 HD11 ' HB3' ' A' ' 10' ' ' GLN . 60.1 tp -90.17 105.94 18.15 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.59 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 25.7 m -80.14 108.92 14.12 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.197 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.44 114.92 33.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.471 0.653 . . . . 0.0 109.512 177.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.603 HG13 ' HB ' ' A' ' 9' ' ' VAL . 14.1 pt -124.77 174.15 9.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.985 -176.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -124.42 96.88 5.07 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 171.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.87 163.65 17.37 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.7 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.936 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.2 Cg_endo -70.08 144.16 51.47 Favored 'Trans proline' 0 N--CA 1.447 -1.247 0 C-N-CA 121.925 1.75 . . . . 0.0 111.99 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.624 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 52.1 mtp180 -61.02 -8.82 3.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.394 0.616 . . . . 0.0 110.729 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -106.99 -5.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.99 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.936 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 92.0 p -56.2 126.64 27.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.55 0.69 . . . . 0.0 110.961 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.532 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.5 t -107.1 -179.15 3.85 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.057 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.69 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.56 -48.82 27.69 Favored 'General case' 0 C--O 1.211 -0.934 0 O-C-N 123.484 0.49 . . . . 0.0 111.822 -172.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.752 ' HA ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.46 -27.18 63.08 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.864 -177.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.83 -52.41 30.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 122.004 0.907 . . . . 0.0 108.978 176.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.45 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.38 -26.89 37.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.125 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 57' ' ' TYR . 8.4 mt -55.7 -57.55 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.261 169.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.0 tt0 -65.45 -32.65 74.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.831 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.467 ' HG2' HD12 ' A' ' 23' ' ' ILE . 45.5 tp60 -61.73 -45.15 95.19 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 121.165 0.507 . . . . 0.0 110.137 175.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.526 ' HB ' HD22 ' A' ' 103' ' ' LEU . 20.5 m -69.05 -38.39 79.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.89 177.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -50.65 -42.25 56.28 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.214 0.531 . . . . 0.0 110.67 171.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.36 -46.56 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.505 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -79.92 -19.91 46.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -90.66 13.21 16.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.878 0.371 . . . . 0.0 110.573 177.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.671 ' HA ' HD21 ' A' ' 49' ' ' LEU . 36.6 ttmt -58.12 102.78 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.259 -176.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.517 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 98.3 m-85 58.27 27.36 15.11 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.06 179.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.2 m -73.23 -85.3 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.77 ' HB2' ' HD2' ' A' ' 16' ' ' PRO . 57.9 t80 -95.64 12.85 28.28 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.9 t 63.92 83.95 0.16 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.581 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.49 HG22 ' O ' ' A' ' 48' ' ' ILE . 41.7 mm -103.28 18.67 4.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 123.043 1.402 . . . . 0.0 107.728 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.671 HD21 ' HA ' ' A' ' 43' ' ' LYS . 2.1 mm? -102.26 10.02 39.55 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.129 -166.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -67.59 -33.38 74.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 174.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -122.72 90.19 49.94 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.609 169.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.57 13.94 2.53 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.491 2.127 . . . . 0.0 111.641 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.478 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.9 p-10 -107.81 136.44 19.7 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.101 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.49 ' HA ' HG21 ' A' ' 35' ' ' ILE . 6.3 Cg_exo -78.68 16.66 1.25 Allowed 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.928 2.419 . . . . 0.0 111.873 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.2 m -87.15 -36.36 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.486 -173.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.531 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 32.3 m-20 -102.2 18.17 21.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.241 0.543 . . . . 0.0 111.298 -173.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.78 ' HB2' HD13 ' A' ' 35' ' ' ILE . 11.8 m-85 -116.5 177.85 4.55 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.616 0.722 . . . . 0.0 110.63 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.42 HG22 ' CA ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -148.26 -179.73 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.844 170.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.989 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -144.27 139.96 28.92 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.591 ' CD1' HG13 ' A' ' 81' ' ' VAL . 2.3 mm? -104.0 127.86 51.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.896 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.3 pt-20 -94.3 86.35 4.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.432 1.111 . . . . 0.0 108.39 167.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.557 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 0.7 OUTLIER -86.71 123.66 32.12 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.078 175.232 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.567 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -115.64 118.33 58.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.224 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 84.4 t -68.94 109.33 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.231 0.539 . . . . 0.0 110.815 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.431 ' HG2' HG22 ' A' ' 63' ' ' VAL . 25.3 mmmt -115.94 90.81 3.42 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.018 175.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.47 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 4.9 p-10 -58.46 169.65 0.87 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.984 -170.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.437 HG21 ' HB ' ' A' ' 72' ' ' THR . 2.1 t -107.24 91.5 3.68 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.378 174.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.1 m -64.96 -24.66 67.58 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 0.0 109.513 176.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -87.56 -154.47 0.26 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.945 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -124.15 96.85 5.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 120.369 -0.533 . . . . 0.0 112.058 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.1 mtpp -131.85 -3.58 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.001 170.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.609 HG22 ' H ' ' A' ' 74' ' ' THR . 37.1 m -157.74 148.71 21.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 9.9 t -72.24 -17.69 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.615 0.245 . . . . 0.0 111.538 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.609 ' H ' HG22 ' A' ' 72' ' ' THR . 16.2 p -137.51 160.19 66.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.324 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -51.02 127.83 22.96 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.239 1.96 . . . . 0.0 111.213 171.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.47 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 20.6 pttp -100.16 147.66 25.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.828 -167.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 14.1 m -99.27 137.51 37.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.442 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.4 t -102.54 99.25 9.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.534 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 6.0 tt0 -94.97 132.05 40.24 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.028 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -129.22 144.09 51.09 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.756 HG11 HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -103.78 141.1 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 118.71 0.686 . . . . 0.0 110.928 -178.024 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.656 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 7.8 mt -101.27 156.81 17.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.521 -176.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.463 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.6 mp -86.1 171.83 11.05 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 165.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.47 -31.38 55.62 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -176.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 6.9 pt20 -121.47 33.13 5.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -176.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.656 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 11.7 mm-40 -72.58 -11.74 60.77 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.559 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 55.5 m 68.08 118.61 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.403 0.621 . . . . 0.0 111.931 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.532 ' H ' ' HA ' ' A' ' 30' ' ' THR . 91.7 t -75.78 -37.08 34.76 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.864 -175.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -72.74 -38.78 67.28 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.559 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 18.1 mt-30 -58.36 -45.71 87.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.309 172.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.516 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.35 -50.99 70.7 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.117 178.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.446 ' OE1' ' HE2' ' A' ' 101' ' ' PHE . 12.1 tt0 -59.35 -24.97 63.81 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.674 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -82.93 -9.21 59.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.129 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 80.3 mttt -86.53 -24.18 25.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.201 0.524 . . . . 0.0 110.538 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.404 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 44.5 m0 -56.16 143.49 33.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.984 -1.007 . . . . 0.0 113.168 -168.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -124.87 20.21 8.42 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.255 -1.338 . . . . 0.0 108.891 177.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.509 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -168.17 155.22 25.78 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 108.526 -1.83 . . . . 0.0 108.526 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.04 103.92 11.18 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 118.08 0.94 . . . . 0.0 111.256 -176.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.567 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -109.64 -147.66 11.97 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.725 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.01 155.05 32.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.989 ' HB3' HD11 ' A' ' 59' ' ' LEU . 94.8 m-85 -85.35 151.4 24.05 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 168.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.582 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.5 mp -131.01 125.87 58.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 O-C-N 121.829 -0.544 . . . . 0.0 110.054 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.526 HD22 ' HB ' ' A' ' 38' ' ' THR . 25.0 tp -80.61 133.63 35.78 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -146.93 159.68 43.26 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 0.8 OUTLIER -82.89 150.77 26.3 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.634 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.2 ptmm? -78.11 -24.09 47.64 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.453 0.644 . . . . 0.0 109.307 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -77.09 3.79 11.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.942 169.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -122.8 1.07 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.756 HG21 HG11 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -116.82 -4.11 11.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.966 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -61.59 82.61 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.847 0.832 . . . . 0.0 113.014 -167.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.05 3.52 38.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.245 170.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.5 t -80.78 164.4 22.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.847 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.9 mmt85 -67.54 -37.76 83.2 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -140.98 142.89 34.24 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.437 176.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.05 -28.02 12.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.258 0.551 . . . . 0.0 110.395 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.9 mttp . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.797 -177.84 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.1 p . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 121.065 0.46 . . . . 0.0 110.696 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.401 ' HB3' ' HG2' ' A' ' 4' ' ' GLU . 23.1 t -143.34 -167.84 2.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.122 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -100.11 -4.14 30.37 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.982 0.42 . . . . 0.0 110.024 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.401 ' HG2' ' HB3' ' A' ' 2' ' ' SER . 9.9 pt-20 -83.06 10.18 8.64 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.53 0.681 . . . . 0.0 110.554 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 5' ' ' GLU . 7.6 pt-20 -113.43 122.77 48.33 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.81 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p -154.9 140.31 17.75 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.607 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 7.2 p90 -132.21 152.18 51.44 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -85.86 129.76 34.74 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.023 0.439 . . . . 0.0 111.396 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.596 HG22 ' CE2' ' A' ' 7' ' ' PHE . 2.0 t -118.1 118.03 56.8 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.323 178.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.627 ' HB3' HD11 ' A' ' 20' ' ' LEU . 80.6 mt-30 -90.56 108.04 19.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 164.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.805 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -121.66 114.33 42.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 121.653 0.74 . . . . 0.0 111.135 -178.888 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.651 ' CD2' HD13 ' A' ' 20' ' ' LEU . 16.7 m-70 -71.43 141.03 50.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.905 -178.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -109.41 162.02 14.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 171.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.63 -21.35 7.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.449 0.643 . . . . 0.0 110.018 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.619 ' HB2' ' HB3' ' A' ' 46' ' ' TYR . 1.2 m -83.52 146.99 51.52 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.965 -175.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -82.89 134.78 7.34 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.418 2.078 . . . . 0.0 112.734 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 168.16 -56.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.458 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.7 tp60 -154.64 96.64 2.58 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 113.451 -1.704 . . . . 0.0 106.934 169.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -47.77 -37.89 28.89 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.383 2.722 . . . . 0.0 112.978 -169.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.651 HD13 ' CD2' ' A' ' 12' ' ' HIS . 41.0 tp -107.47 109.68 21.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.081 177.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 21.6 m -85.58 108.45 17.97 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.425 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.4 t -94.22 111.78 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 O-C-N 122.055 -0.403 . . . . 0.0 110.306 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 9' ' ' VAL . 22.5 pt -123.15 170.3 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.161 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 tttt -119.16 113.73 21.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.408 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -115.43 168.49 8.22 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.742 -176.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.891 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.6 Cg_endo -75.38 143.46 27.91 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.01 1.807 . . . . 0.0 111.568 -179.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.607 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 67.2 mtt180 -59.31 -18.37 37.27 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.506 0.67 . . . . 0.0 110.495 -176.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.38 -14.34 9.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.137 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.891 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.1 p -55.42 128.52 34.68 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.753 0.787 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.526 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -111.23 177.55 4.62 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.364 176.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.74 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -49.78 -52.77 29.51 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 123.642 0.589 . . . . 0.0 111.306 -171.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.829 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -57.17 -34.92 68.95 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.721 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.47 -52.4 10.78 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.467 0.651 . . . . 0.0 110.523 -175.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.738 HG11 HD22 ' A' ' 59' ' ' LEU . 3.3 p -62.54 -27.62 43.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.064 177.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.74 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.6 mm -56.01 -57.29 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.976 172.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.436 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 10.1 tt0 -71.82 -32.55 67.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -177.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -56.94 -37.77 71.99 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.04 0.448 . . . . 0.0 110.077 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.0 m -70.52 -38.5 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.965 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 9.2 mp -54.59 -43.62 72.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.851 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 51.2 t -71.07 -37.57 72.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.762 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -73.46 -25.43 60.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.885 -177.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.692 ' HB1' ' HB2' ' A' ' 46' ' ' TYR . . . -108.52 17.21 22.29 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -172.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.501 ' C ' ' H ' ' A' ' 45' ' ' SER . 17.1 pttm -65.04 107.58 1.56 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.128 0.49 . . . . 0.0 110.978 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.844 ' HA ' HD21 ' A' ' 49' ' ' LEU . 85.4 m-85 71.07 -28.9 0.18 Allowed 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.106 -177.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.521 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 25.3 m -53.71 -69.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.55 0.74 . . . . 0.0 110.9 176.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.692 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 26.9 m-85 -88.44 11.81 15.97 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 173.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.446 ' C ' HD22 ' A' ' 49' ' ' LEU . 1.1 m 54.8 39.86 31.64 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.355 -1.293 . . . . 0.0 110.906 -174.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.481 ' O ' HD13 ' A' ' 49' ' ' LEU . 38.5 mm -85.81 78.51 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.475 174.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.844 HD21 ' HA ' ' A' ' 44' ' ' TYR . 2.0 mm? -124.68 -23.61 4.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.6 m -57.91 -49.36 77.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.759 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -110.02 93.05 14.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 174.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -84.76 -3.08 9.84 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.89 2.393 . . . . 0.0 111.941 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -103.43 133.79 20.11 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.863 177.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.829 ' HB2' HE22 ' A' ' 32' ' ' GLN . 89.8 Cg_endo -85.59 5.35 6.15 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.658 2.239 . . . . 0.0 113.074 -175.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.46 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 15.5 p -85.26 -6.11 59.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.204 -175.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.526 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.2 m-20 -103.59 4.54 35.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.883 0.373 . . . . 0.0 110.552 175.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.602 ' HB3' HD12 ' A' ' 35' ' ' ILE . 61.1 m-85 -110.4 155.94 21.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 110.832 -177.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -143.02 146.75 21.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 170.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.781 HD21 ' HB3' ' A' ' 101' ' ' PHE . 16.1 tp -99.68 147.8 25.03 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.046 0.451 . . . . 0.0 110.803 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.621 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 1.4 mm? -106.1 133.34 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.594 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.676 ' HB3' HD21 ' A' ' 82' ' ' LEU . 11.8 pt-20 -94.59 85.23 4.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.706 1.241 . . . . 0.0 108.484 170.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.615 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 14.6 tt0 -86.12 122.86 30.74 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.387 -0.82 . . . . 0.0 109.262 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.538 HG21 ' H ' ' A' ' 96' ' ' LYS . 0.9 OUTLIER -113.36 111.98 38.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-O 121.234 0.54 . . . . 0.0 110.173 176.552 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.641 HG23 ' HA2' ' A' ' 99' ' ' GLY . 79.7 t -70.56 99.78 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.177 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.629 ' HD3' ' HB2' ' A' ' 96' ' ' LYS . 24.6 mmmt -94.49 87.63 5.2 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.179 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.428 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 9.5 p-10 -80.57 123.91 28.52 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.422 ' O ' ' HB ' ' A' ' 73' ' ' THR . 5.5 t -149.01 106.76 3.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.661 0.743 . . . . 0.0 111.418 -174.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.555 HG23 ' H ' ' A' ' 73' ' ' THR . 62.4 m -101.31 -57.88 2.0 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.122 171.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 62.66 -82.19 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.256 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -109.82 -78.99 0.58 Allowed 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.058 -170.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -82.41 150.65 26.98 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.8 m -54.34 101.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.274 0.559 . . . . 0.0 110.757 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.555 ' H ' HG23 ' A' ' 68' ' ' THR . 17.7 m -121.9 128.9 52.09 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.376 -177.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.44 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 32.7 p -71.26 142.91 87.56 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.795 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 31.6 Cg_exo -60.14 148.13 90.7 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 123.003 2.469 . . . . 0.0 111.248 174.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.5 157.42 45.68 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.523 -171.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 57.0 m -118.1 103.77 10.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.616 174.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.531 ' HB3' HG13 ' A' ' 63' ' ' VAL . 20.7 t -80.29 99.35 7.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 8.4 tt0 -94.25 131.26 40.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.536 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 35.6 ttt-85 -128.35 152.73 47.82 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.869 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.92 144.23 16.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.988 0.813 . . . . 0.0 110.719 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.676 HD21 ' HB3' ' A' ' 61' ' ' GLU . 16.9 mt -100.17 158.8 15.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.284 -176.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.8 mp -92.46 -179.19 5.13 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.0 -52.3 34.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.302 0.377 . . . . 0.0 111.337 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -119.52 51.59 1.15 Allowed 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.6 tp10 -73.12 -21.17 60.78 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.101 0.477 . . . . 0.0 109.738 170.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.704 ' HB2' HE21 ' A' ' 90' ' ' GLN . 54.9 m 73.7 124.98 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.267 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.524 ' H ' ' HA ' ' A' ' 30' ' ' THR . 89.4 t -75.05 -42.94 45.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.521 -173.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 92.9 t80 -73.02 -33.38 65.71 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.704 HE21 ' HB2' ' A' ' 87' ' ' CYS . 14.5 mt-30 -64.12 -41.25 97.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.568 172.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.13 -42.47 93.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.182 0.515 . . . . 0.0 110.386 176.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -63.39 -28.66 70.14 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.643 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.8 p -78.65 -6.8 56.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.874 0.369 . . . . 0.0 110.934 178.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 34.3 mmtp -88.19 -22.04 24.24 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.302 0.573 . . . . 0.0 109.829 176.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.449 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 41.5 m0 -62.3 148.29 45.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.866 -173.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.629 ' HB2' ' HD3' ' A' ' 65' ' ' LYS . 95.1 mttt -117.59 13.1 14.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.122 178.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -167.58 173.8 42.64 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.08 100.46 13.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 117.777 0.789 . . . . 0.0 111.208 -176.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.641 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -104.3 -145.11 13.91 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.997 -178.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.589 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 2.9 mptp? -153.2 153.16 32.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 174.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.805 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 98.3 m-85 -87.95 122.59 31.75 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 170.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.621 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -101.19 123.61 54.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 O-C-N 121.81 -0.556 . . . . 0.0 110.444 -171.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.62 HD12 HD13 ' A' ' 35' ' ' ILE . 6.0 tp -74.99 127.19 32.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.558 ' HD2' HG23 ' A' ' 109' ' ' VAL . 15.5 ttmm -147.03 170.25 17.53 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.1 mp -95.98 160.11 14.63 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 175.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 10.9 ptmm? -89.06 -5.6 57.74 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 122.11 0.957 . . . . 0.0 109.6 175.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.68 -17.87 34.77 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.361 166.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.472 ' HG3' ' HB2' ' A' ' 105' ' ' LEU . 96.5 mt-30 -95.87 -40.14 9.46 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.869 HG11 HG11 ' A' ' 81' ' ' VAL . 76.1 t -88.76 72.38 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-N 113.988 -1.46 . . . . 0.0 108.85 167.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' A' ' 112' ' ' SER . 1.3 mm-40 -110.63 -161.28 0.75 Allowed 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.95 41.93 0.61 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 110' ' ' GLN . 15.8 m -44.98 109.67 0.18 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 113.879 -1.509 . . . . 0.0 113.426 -167.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.443 ' HA ' ' NE ' ' A' ' 113' ' ' ARG . 4.4 mmp_? -86.18 99.83 11.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 170.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 75.23 -52.67 0.66 Allowed 'General case' 0 N--CA 1.468 0.445 0 O-C-N 124.018 0.824 . . . . 0.0 111.065 -174.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -158.45 149.12 20.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.483 0.182 . . . . 0.0 110.896 177.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 123.646 0.778 . . . . 0.0 112.286 178.983 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.3 m . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 120.899 0.381 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -110.14 178.33 4.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.287 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -90.25 -15.62 30.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.408 0.623 . . . . 0.0 109.862 177.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -88.01 10.57 18.58 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.48 -173.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 5' ' ' GLU . 5.7 pt-20 -124.29 111.25 15.6 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.724 0.773 . . . . 0.0 111.873 -173.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.9 p -150.37 139.48 21.12 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.316 -0.857 . . . . 0.0 109.1 170.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.713 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.3 p90 -137.74 155.04 49.5 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -177.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -90.21 133.74 34.73 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.063 0.459 . . . . 0.0 111.586 -174.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.587 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -119.52 121.23 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.274 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.569 ' HB3' HD11 ' A' ' 20' ' ' LEU . 95.9 mt-30 -95.56 108.45 20.7 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 166.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.77 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -125.43 123.44 64.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-O 121.393 0.616 . . . . 0.0 111.092 -175.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.56 ' HB2' HG13 ' A' ' 102' ' ' ILE . 63.2 m-70 -79.19 150.41 31.67 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.695 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -120.52 172.82 7.56 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 169.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -82.18 -21.7 9.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.083 0.468 . . . . 0.0 110.523 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.603 ' HB2' ' HD2' ' A' ' 46' ' ' TYR . 4.6 m -77.36 160.68 74.85 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.285 -176.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.472 ' HB2' ' H ' ' A' ' 17' ' ' GLU . 85.3 Cg_endo -79.18 -141.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.781 2.321 . . . . 0.0 112.612 177.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.472 ' H ' ' HB2' ' A' ' 16' ' ' PRO . 10.3 tp10 72.39 -66.81 0.29 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.464 0.706 . . . . 0.0 110.33 -175.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.488 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.3 tp60 -148.07 94.83 4.23 Favored Pre-proline 0 C--N 1.317 -0.837 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.87 -41.92 25.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.564 2.843 . . . . 0.0 113.165 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 10' ' ' GLN . 58.3 tp -101.13 107.89 19.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.838 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.6 m -77.5 144.97 37.3 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 174.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.0 t -125.99 118.08 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.587 HG13 ' HB ' ' A' ' 9' ' ' VAL . 7.3 pt -127.41 169.48 18.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 tttt -120.59 104.16 9.72 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 171.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.576 ' HA ' HE22 ' A' ' 37' ' ' GLN . . . -102.35 170.02 6.87 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.792 -175.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.881 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 3.8 Cg_endo -75.75 142.65 25.89 Favored 'Trans proline' 0 N--CA 1.446 -1.321 0 C-N-CA 122.007 1.804 . . . . 0.0 111.302 178.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.713 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 77.9 mtt180 -59.89 -15.62 22.79 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.219 0.533 . . . . 0.0 110.82 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.91 -12.58 8.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.841 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.881 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.9 p -54.69 127.19 27.08 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.63 0.729 . . . . 0.0 110.829 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.578 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 2.5 t -107.95 -179.08 3.79 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.515 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -48.83 -51.52 29.07 Favored 'General case' 0 C--O 1.212 -0.897 0 O-C-N 123.579 0.549 . . . . 0.0 110.862 -172.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -37.8 69.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -70.7 -53.37 15.89 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 122.234 1.016 . . . . 0.0 109.966 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.651 HG11 HD22 ' A' ' 59' ' ' LEU . 3.0 p -66.05 -27.23 40.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 113.525 -1.67 . . . . 0.0 110.175 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.56 HD13 HD12 ' A' ' 103' ' ' LEU . 3.7 mm -56.12 -57.32 8.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.797 172.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.55 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 4.6 tp-100 -69.25 -33.6 73.5 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.576 HE22 ' HA ' ' A' ' 25' ' ' ALA . 32.6 tt0 -60.41 -42.3 95.72 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.859 0.361 . . . . 0.0 110.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.1 m -67.34 -37.07 82.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.046 174.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.4 mp -55.18 -41.9 72.5 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.131 0.491 . . . . 0.0 110.611 172.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.509 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 52.5 t -72.65 -34.28 67.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.886 -178.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -74.3 -39.29 63.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.013 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.637 ' HB1' ' HB2' ' A' ' 46' ' ' TYR . . . -96.1 0.25 51.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -172.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 40' ' ' CYS . 20.2 pttm -61.95 118.1 6.82 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.095 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.832 ' HA ' HD21 ' A' ' 49' ' ' LEU . 83.5 m-85 71.63 -41.64 0.51 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.933 0.893 . . . . 0.0 111.037 -176.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.502 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 29.5 m -50.4 -67.25 0.27 Allowed 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.782 0.833 . . . . 0.0 111.358 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.637 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 5.8 m-85 -92.39 19.85 6.75 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.448 ' C ' HD22 ' A' ' 49' ' ' LEU . 3.8 p 44.82 44.3 7.63 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.605 -170.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.506 ' O ' HD13 ' A' ' 49' ' ' LEU . 46.6 mm -86.49 75.16 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.482 174.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.832 HD21 ' HA ' ' A' ' 44' ' ' TYR . 1.7 mm? -122.51 -5.17 8.75 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.215 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 m -68.03 -50.56 54.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.214 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.418 ' HB3' ' HE1' ' A' ' 57' ' ' TYR . 6.6 m-20 -117.28 94.51 45.32 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.4 175.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -84.6 0.87 8.91 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.696 2.264 . . . . 0.0 111.292 175.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -103.27 124.56 37.85 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.938 177.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.54 -2.4 12.44 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.912 2.408 . . . . 0.0 113.091 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.8 p -69.88 -23.68 63.3 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.537 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 18.0 m-20 -97.23 9.41 42.29 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.622 0.248 . . . . 0.0 111.574 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 43.0 m-85 -111.55 153.64 25.95 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.918 0.39 . . . . 0.0 110.738 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.58 142.69 30.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.059 169.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.651 HD22 HG11 ' A' ' 34' ' ' VAL . 15.8 tp -93.66 145.33 24.63 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.07 0.462 . . . . 0.0 110.412 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.7 mm? -107.04 129.4 54.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.831 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.671 ' HB3' HD21 ' A' ' 82' ' ' LEU . 15.4 pt-20 -91.13 85.34 5.87 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.565 1.174 . . . . 0.0 108.283 169.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.639 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 14.3 tt0 -86.29 123.82 31.97 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.632 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.572 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.5 OUTLIER -117.77 116.29 51.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.864 175.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.546 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 95.6 t -65.66 104.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.675 0.75 . . . . 0.0 110.385 178.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.552 ' HG2' HG22 ' A' ' 63' ' ' VAL . 19.8 mmmt -111.28 98.38 7.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.171 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.528 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 4.0 p-10 -60.19 144.13 50.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.776 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.3 t -119.51 18.54 12.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.121 0.486 . . . . 0.0 110.302 -176.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 33.0 m -55.65 -67.03 0.32 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.786 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.416 ' HB2' ' H ' ' A' ' 70' ' ' LYS . 45.0 m-20 57.33 -88.36 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.111 174.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' H ' ' HB2' ' A' ' 69' ' ' ASN . 14.5 mmmm -89.56 -40.72 12.44 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.505 -173.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 71' ' ' LYS . 4.6 ttmp? -142.25 155.7 45.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.856 -173.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.9 m -48.1 107.42 0.12 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.279 0.562 . . . . 0.0 111.711 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.1 m -142.64 132.84 24.63 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.497 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 33.4 p -58.23 133.97 84.6 Favored Pre-proline 0 C--N 1.331 -0.232 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 66' ' ' ASP . 25.3 Cg_exo -66.3 142.76 67.81 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.102 2.535 . . . . 0.0 112.284 178.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -112.33 165.73 11.93 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.98 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 2.0 p -116.41 103.79 10.8 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -75.82 99.03 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.221 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.8 tt0 -94.49 131.44 40.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -175.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.541 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 3.6 tmt_? -132.93 137.41 46.6 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 1.033 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -98.05 137.41 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.679 -173.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.71 HD22 ' HG2' ' A' ' 86' ' ' GLU . 11.7 mt -94.04 168.64 10.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.258 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 83' ' ' LEU . 6.4 mp -107.82 -174.38 2.51 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.519 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -47.13 -53.71 12.26 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.397 0.435 . . . . 0.0 111.583 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 5.7 pt20 -125.25 67.54 1.13 Allowed 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.71 ' HG2' HD22 ' A' ' 82' ' ' LEU . 16.6 tp10 -77.49 -23.97 50.21 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 165.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 72.0 m 75.12 121.44 0.04 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.233 -174.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.503 ' H ' ' HA ' ' A' ' 30' ' ' THR . 78.2 t -75.2 -40.15 43.49 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-O 121.203 0.525 . . . . 0.0 110.383 -172.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 87.9 t80 -73.41 -32.73 64.6 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.637 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 12.9 mt-30 -69.82 -33.49 72.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.969 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.39 -43.7 66.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.245 0.545 . . . . 0.0 110.067 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -62.24 -29.44 70.4 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.506 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.8 p -81.02 -4.91 56.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.852 0.358 . . . . 0.0 111.277 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 32.7 mmtp -85.15 -24.18 28.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.472 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.0 m0 -61.74 148.02 44.29 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.41 -169.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -127.47 19.74 6.78 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.238 -1.347 . . . . 0.0 108.818 176.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -161.07 169.93 36.78 Favored Glycine 0 N--CA 1.441 -0.998 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -92.59 98.8 11.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 118.047 0.923 . . . . 0.0 111.137 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.639 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -110.65 -152.1 12.89 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 119.965 -1.112 . . . . 0.0 112.109 -177.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.522 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.9 mptp? -153.81 155.03 35.06 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.77 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 94.3 m-85 -85.19 126.73 33.89 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.937 -0.705 . . . . 0.0 109.147 171.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 1.7 mp -103.2 124.35 57.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 O-C-N 121.771 -0.581 . . . . 0.0 110.633 -175.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.56 HD12 HD13 ' A' ' 35' ' ' ILE . 8.4 tp -81.84 105.5 13.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.527 ' HD2' HG23 ' A' ' 109' ' ' VAL . 18.5 ttmm -126.09 171.37 10.89 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 3.5 mp -92.58 162.3 14.24 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 13.7 ptmm? -91.03 -7.99 50.34 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.925 0.869 . . . . 0.0 109.617 174.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -83.96 -15.23 48.58 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.205 168.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -102.82 -38.2 7.53 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 1.033 HG11 HG11 ' A' ' 81' ' ' VAL . 76.1 t -88.77 78.09 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.875 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.203 166.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 1.2 mm-40 -123.11 -168.83 1.83 Allowed 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.032 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.29 80.44 1.84 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 170.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.4 m -61.38 91.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.984 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.476 ' HA ' ' HD3' ' A' ' 113' ' ' ARG . 17.0 mmt180 -91.22 97.19 10.98 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 168.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 113' ' ' ARG . 39.6 mt-10 75.5 -42.85 0.48 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.324 1.015 . . . . 0.0 110.798 -174.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -169.43 167.32 10.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm . . . . . 0 N--CA 1.468 0.449 0 O-C-N 123.314 0.384 . . . . 0.0 111.438 178.311 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 120.937 0.399 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -142.91 -164.9 1.94 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.536 -177.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -113.54 7.65 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.242 0.544 . . . . 0.0 109.663 175.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -88.41 1.2 55.22 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.162 174.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -104.23 110.61 22.89 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.789 -174.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p -150.91 139.97 21.08 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.891 178.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.951 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.0 p90 -136.53 153.18 51.08 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -89.05 130.29 35.53 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.331 -175.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.541 HG22 ' CE2' ' A' ' 7' ' ' PHE . 3.3 t -114.5 131.58 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.314 178.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 100' ' ' LYS . 80.4 mt-30 -100.68 108.08 19.85 Favored 'General case' 0 N--CA 1.428 -1.557 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 162.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.755 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.06 113.98 40.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.591 ' HB2' HG13 ' A' ' 102' ' ' ILE . 83.2 m-70 -68.07 144.88 54.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.168 -177.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -120.3 165.94 14.18 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.3 t -79.35 -25.01 12.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.973 0.416 . . . . 0.0 110.429 -178.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.471 ' HB2' ' CD2' ' A' ' 46' ' ' TYR . 2.6 m -78.3 161.84 68.75 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.309 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.422 ' O ' ' HB3' ' A' ' 17' ' ' GLU . 5.8 Cg_exo -79.41 -141.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.109 2.539 . . . . 0.0 112.239 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 16' ' ' PRO . 10.7 tp10 71.38 -67.85 0.24 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.22 0.608 . . . . 0.0 109.432 -173.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -151.09 105.4 2.99 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 174.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -59.5 -21.06 60.06 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.04 2.493 . . . . 0.0 112.799 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.597 HD11 ' HB3' ' A' ' 10' ' ' GLN . 54.3 tp -108.87 106.24 16.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.255 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.561 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 99.6 m -82.14 109.49 16.5 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.703 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.4 t -93.09 111.51 24.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.513 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.5 pt -124.13 175.9 6.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.053 0.454 . . . . 0.0 111.209 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.0 tttt -124.0 110.56 14.93 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -110.42 169.43 6.36 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.635 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.957 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 1.2 Cg_endo -74.36 142.52 30.16 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 121.608 1.539 . . . . 0.0 111.382 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.951 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 57.1 mtt180 -64.53 -1.44 1.79 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.175 0.512 . . . . 0.0 111.279 -175.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 m -112.88 -6.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.95 175.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.957 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.9 p -50.0 139.84 13.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.509 0.671 . . . . 0.0 111.717 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.559 ' CB ' ' HA ' ' A' ' 87' ' ' CYS . 4.2 t -118.33 174.05 6.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.328 174.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.58 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.7 -52.02 44.13 Favored 'General case' 0 C--O 1.213 -0.838 0 O-C-N 123.707 0.629 . . . . 0.0 111.183 -171.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.791 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -55.96 -33.81 65.11 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.564 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -76.07 -52.54 9.95 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.844 0.83 . . . . 0.0 110.46 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.594 ' CG1' HD22 ' A' ' 59' ' ' LEU . 6.0 p -64.43 -27.28 42.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 114.188 -1.369 . . . . 0.0 110.145 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.58 HG12 ' O ' ' A' ' 31' ' ' ALA . 6.4 mm -56.46 -57.59 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.732 171.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 4.0 tp-100 -66.97 -34.33 77.52 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.948 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -58.87 -43.02 90.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 120.542 0.211 . . . . 0.0 110.855 176.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.44 HG21 HD22 ' A' ' 103' ' ' LEU . 15.6 m -68.3 -34.69 76.6 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 35' ' ' ILE . 8.1 mp -54.6 -54.48 40.81 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.234 0.54 . . . . 0.0 110.472 172.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 52.2 t -64.63 -34.99 79.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.875 179.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.31 -37.35 87.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.221 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.82 ' HB1' ' HB2' ' A' ' 46' ' ' TYR . . . -106.18 15.45 26.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -171.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' A' ' 45' ' ' SER . 24.4 pttm -58.73 107.48 0.52 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.875 0.369 . . . . 0.0 110.587 177.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.878 ' HA ' HD21 ' A' ' 49' ' ' LEU . 97.3 m-85 69.52 -33.55 0.26 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.711 0.805 . . . . 0.0 111.319 -176.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.518 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 22.9 m -50.07 -64.23 0.87 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.827 0.851 . . . . 0.0 111.32 178.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.82 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 3.5 m-30 -96.15 19.19 12.15 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.422 ' C ' HD22 ' A' ' 49' ' ' LEU . 31.4 p 48.16 38.77 10.5 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.846 -172.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.478 ' O ' HD13 ' A' ' 49' ' ' LEU . 42.3 mm -84.96 76.07 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.61 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.878 HD21 ' HA ' ' A' ' 44' ' ' TYR . 1.9 mm? -122.87 -15.14 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.882 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -60.33 -43.67 96.21 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.751 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -121.1 92.63 48.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.142 172.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -81.72 -0.23 10.27 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.632 2.221 . . . . 0.0 110.926 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -97.98 125.66 43.24 Favored Pre-proline 0 N--CA 1.449 -0.496 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.654 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.791 ' HB2' HE22 ' A' ' 32' ' ' GLN . 94.0 Cg_endo -81.15 3.92 7.41 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.807 2.338 . . . . 0.0 112.324 -176.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 p -84.21 -26.84 28.43 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.798 -177.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 1.1 m-20 -89.9 4.93 48.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.147 0.499 . . . . 0.0 111.051 -173.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 38.3 m-85 -111.51 160.84 16.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.185 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.44 137.05 36.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.914 168.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.628 HD21 ' HB3' ' A' ' 101' ' ' PHE . 22.4 tp -89.94 140.51 29.55 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.205 0.526 . . . . 0.0 110.561 -177.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.569 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.6 mm? -101.67 128.89 47.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.731 178.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.602 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 14.3 pt-20 -92.18 84.25 5.21 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.353 1.073 . . . . 0.0 108.302 170.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.606 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 20.1 tt0 -86.08 121.86 29.29 Favored 'General case' 0 N--CA 1.425 -1.719 0 O-C-N 120.902 -1.124 . . . . 0.0 109.506 176.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.538 HG13 ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -104.37 104.47 16.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.358 174.059 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' A' ' 98' ' ' ALA . 61.3 t -63.93 106.66 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.808 179.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HG2' HG22 ' A' ' 63' ' ' VAL . 23.4 mmmt -104.02 92.15 4.26 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.808 -178.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -78.76 137.18 37.63 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.989 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.7 t -156.21 147.66 22.61 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.125 0.488 . . . . 0.0 110.342 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.523 ' HA ' ' HB ' ' A' ' 73' ' ' THR . 46.0 m -149.1 -59.41 0.22 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 32.0 m-20 57.4 -85.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.321 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -86.45 -62.94 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.065 -169.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -125.07 161.52 26.6 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -176.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.7 m -50.54 109.03 0.27 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.37 0.605 . . . . 0.0 111.687 -178.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.523 ' HB ' ' HA ' ' A' ' 68' ' ' THR . 34.4 m -131.03 138.25 49.54 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.432 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 39.8 p -76.97 140.38 66.65 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-O 120.732 0.301 . . . . 0.0 111.429 -176.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -61.58 148.06 93.91 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 123.193 2.596 . . . . 0.0 111.608 176.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -129.44 176.17 8.18 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.874 -171.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 83.7 p -141.44 119.99 12.44 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.538 ' HB3' HG13 ' A' ' 63' ' ' VAL . 22.7 t -91.0 102.64 15.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.606 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -95.14 131.35 41.25 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.075 0.464 . . . . 0.0 110.226 -175.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.572 ' HD3' ' OE2' ' A' ' 61' ' ' GLU . 32.7 ttt-85 -127.0 151.9 47.96 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 1.065 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.17 140.14 27.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 118.851 0.75 . . . . 0.0 110.448 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.561 HD12 ' HB3' ' A' ' 59' ' ' LEU . 10.0 mt -93.69 165.5 12.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.551 0.691 . . . . 0.0 111.589 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.0 mp -96.12 -174.38 3.08 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.652 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.416 ' OD2' ' HG3' ' A' ' 32' ' ' GLN . 15.3 t70 -53.29 -51.11 63.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.275 0.559 . . . . 0.0 110.798 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.481 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 12.9 pt20 -125.84 55.54 1.45 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.574 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 9.0 tp10 -73.46 -23.03 60.03 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.712 ' HB2' HE21 ' A' ' 90' ' ' GLN . 7.5 m 76.0 132.15 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.013 -176.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.527 ' H ' ' HA ' ' A' ' 30' ' ' THR . 69.5 t -76.04 -42.81 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-O 121.176 0.512 . . . . 0.0 110.155 -174.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -73.0 -33.49 65.81 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.712 HE21 ' HB2' ' A' ' 87' ' ' CYS . 15.8 mt-30 -67.55 -36.79 81.65 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.157 173.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -45.35 70.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.557 0.694 . . . . 0.0 110.344 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.527 HE22 ' HE2' ' A' ' 7' ' ' PHE . 4.8 tt0 -61.7 -32.57 72.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.816 -177.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.5 p -76.24 -16.11 59.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.648 0.261 . . . . 0.0 111.432 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 24.5 mmtp -74.67 -27.31 60.36 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.365 0.603 . . . . 0.0 110.016 176.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.41 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -55.68 144.67 26.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.765 -1.107 . . . . 0.0 113.695 -169.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -108.04 14.74 24.93 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.222 -1.354 . . . . 0.0 109.255 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.36 -166.59 30.38 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.611 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -107.46 107.97 19.08 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 117.54 0.67 . . . . 0.0 110.999 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.595 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -116.68 -147.47 8.73 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.575 -0.822 . . . . 0.0 111.777 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.652 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -152.05 160.46 43.44 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 173.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.755 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 85.9 m-85 -88.87 123.91 33.69 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 169.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.8 mp -103.07 121.97 54.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 121.952 -0.468 . . . . 0.0 110.188 -175.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.566 HD12 HD13 ' A' ' 35' ' ' ILE . 7.8 tp -79.31 112.07 16.18 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.635 ' HD2' HG23 ' A' ' 109' ' ' VAL . 17.7 ttmm -131.39 168.88 16.83 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 2.1 mp -91.53 161.17 15.07 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 14.3 ptmm? -88.27 -11.47 46.43 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 121.762 0.792 . . . . 0.0 109.486 174.148 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -79.01 -10.61 59.88 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.509 167.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -107.55 -39.22 5.68 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 1.065 HG11 HG11 ' A' ' 81' ' ' VAL . 56.6 t -99.14 91.53 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.528 169.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 1.1 tm0? -131.61 -79.0 0.52 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.517 1.151 . . . . 0.0 110.197 -177.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -168.88 63.17 0.06 Allowed 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 112.703 -2.044 . . . . 0.0 107.457 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 116' ' ' LYS . 9.4 m -54.02 103.76 0.09 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.125 -1.398 . . . . 0.0 112.136 -174.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -89.7 95.13 10.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 71.56 -57.32 0.61 Allowed 'General case' 0 N--CA 1.466 0.369 0 O-C-N 124.088 0.867 . . . . 0.0 110.412 -171.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -164.92 143.93 6.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.561 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 112' ' ' SER . 47.3 mmtm . . . . . 0 N--CA 1.467 0.396 0 O-C-N 123.581 0.551 . . . . 0.0 111.085 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.517 ' HB3' ' HG2' ' A' ' 5' ' ' GLU . 32.8 t -83.8 169.87 14.74 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.6 -16.26 17.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -99.06 13.49 32.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.207 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.517 ' HG2' ' HB3' ' A' ' 2' ' ' SER . 4.0 pt-20 -103.89 109.57 21.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.461 0.648 . . . . 0.0 111.063 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB2' ' HE2' ' A' ' 24' ' ' LYS . 17.4 m -156.48 131.39 9.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.938 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.91 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.0 p90 -114.4 157.31 23.04 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -87.95 133.73 33.87 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.002 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.546 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.0 t -118.69 129.56 74.76 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.442 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.736 ' HB3' HD11 ' A' ' 20' ' ' LEU . 79.7 mt-30 -96.97 108.03 20.67 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 163.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.724 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -122.88 118.95 56.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.33 0.586 . . . . 0.0 110.499 178.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.584 ' HB2' HG13 ' A' ' 102' ' ' ILE . 29.1 m-70 -76.13 140.38 41.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.935 -177.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -105.71 167.38 9.81 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 171.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.61 -13.44 8.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.315 0.579 . . . . 0.0 110.542 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.82 ' HB2' ' HB3' ' A' ' 46' ' ' TYR . 6.0 m -98.7 156.78 35.24 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.589 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_endo -86.09 139.84 6.42 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.997 2.464 . . . . 0.0 112.715 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 164.45 -64.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 106.599 -1.63 . . . . 0.0 106.599 -177.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.458 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 6.9 tp60 -151.62 84.73 5.02 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 168.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -46.02 -40.77 20.89 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.666 2.91 . . . . 0.0 113.197 -169.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.736 HD11 ' HB3' ' A' ' 10' ' ' GLN . 45.0 tp -89.72 103.1 15.78 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 172.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 50.6 m -83.36 108.05 16.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.419 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 56.5 t -95.65 111.53 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.546 HG13 ' HB ' ' A' ' 9' ' ' VAL . 12.8 pt -120.69 175.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.194 0.521 . . . . 0.0 111.323 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 6' ' ' SER . 39.8 tttt -122.87 120.15 32.64 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 170.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -126.74 167.88 16.15 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -171.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.907 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.2 Cg_exo -68.2 139.59 46.63 Favored 'Trans proline' 0 N--CA 1.442 -1.52 0 C-N-CA 121.293 1.329 . . . . 0.0 111.429 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.91 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 42.3 mtt180 -66.72 -0.86 3.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.233 0.539 . . . . 0.0 110.701 -177.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.2 m -112.26 -9.1 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.979 174.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.907 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 78.5 p -46.45 139.59 4.85 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.891 0.853 . . . . 0.0 112.724 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.554 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 4.3 t -116.35 174.74 5.89 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.264 172.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.711 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -50.19 -50.79 48.28 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 123.579 0.55 . . . . 0.0 111.576 -171.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.732 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -57.94 -34.63 70.1 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.43 -177.805 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.33 -52.38 16.45 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.043 0.925 . . . . 0.0 110.084 -176.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.839 HG11 HD22 ' A' ' 59' ' ' LEU . 8.0 p -65.09 -27.94 43.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.261 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.711 HG12 ' O ' ' A' ' 31' ' ' ALA . 7.2 mm -56.77 -58.97 3.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.378 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 10.2 tt0 -73.77 -32.49 63.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.509 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.7 -42.72 84.31 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 120.781 0.324 . . . . 0.0 110.156 174.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 36.3 m -66.32 -38.06 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.017 175.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.574 HD13 ' O ' ' A' ' 35' ' ' ILE . 7.8 mp -53.5 -44.25 68.9 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.804 173.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 43' ' ' LYS . 41.1 t -63.19 -34.14 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.258 0.551 . . . . 0.0 111.026 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -80.48 -21.58 41.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.216 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.553 ' HA ' ' HD1' ' A' ' 46' ' ' TYR . . . -105.67 -10.12 16.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -172.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 21.0 pttm -59.33 113.88 2.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.372 . . . . 0.0 110.828 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.796 ' HA ' HD21 ' A' ' 49' ' ' LEU . 82.7 m-85 70.71 -43.67 0.56 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.016 0.927 . . . . 0.0 110.964 -176.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.3 m -45.54 -60.5 2.15 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 123.949 0.9 . . . . 0.0 111.156 177.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.82 ' HB3' ' HB2' ' A' ' 15' ' ' SER . 19.7 m-85 -102.15 18.58 20.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 177.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.454 ' C ' HD22 ' A' ' 49' ' ' LEU . 38.7 p 48.72 35.6 6.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.667 -172.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.454 ' O ' HD13 ' A' ' 49' ' ' LEU . 41.7 mm -82.93 79.15 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.173 172.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.796 HD21 ' HA ' ' A' ' 44' ' ' TYR . 2.2 mm? -121.78 -13.61 8.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.163 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.2 m -66.68 -46.78 74.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.958 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -122.22 87.11 47.88 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.548 175.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.46 8.25 4.11 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.313 2.675 . . . . 0.0 111.574 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -100.44 127.72 32.16 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.334 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.732 ' HB2' HE22 ' A' ' 32' ' ' GLN . 98.4 Cg_endo -81.23 5.91 5.94 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.888 2.392 . . . . 0.0 113.529 -174.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.502 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 13.2 p -79.19 -35.33 41.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.007 -175.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.533 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 60.5 m-20 -92.55 10.98 28.03 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -173.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 35' ' ' ILE . 42.2 m-85 -113.09 151.9 30.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.066 0.46 . . . . 0.0 111.1 -175.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.5 OUTLIER -138.8 142.92 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.765 170.732 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.839 HD22 HG11 ' A' ' 34' ' ' VAL . 19.6 tp -94.57 142.56 27.31 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.015 0.436 . . . . 0.0 110.014 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.543 HD12 ' HG2' ' A' ' 79' ' ' GLN . 2.1 mm? -106.45 125.06 50.52 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.633 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.655 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.9 pt-20 -88.62 85.47 6.82 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 122.505 1.145 . . . . 0.0 108.351 171.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.544 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 1.8 tm-20 -87.14 121.73 29.99 Favored 'General case' 0 N--CA 1.418 -2.032 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.592 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -109.51 112.4 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.464 176.184 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.651 HG23 ' HA2' ' A' ' 99' ' ' GLY . 61.1 t -65.78 107.42 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.343 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.537 ' HD3' ' HB2' ' A' ' 96' ' ' LYS . 23.4 mmmt -107.64 93.77 4.72 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.566 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.407 ' HA ' ' HA ' ' A' ' 75' ' ' PRO . 6.6 p-10 -80.51 140.59 35.8 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 172.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -141.19 41.04 1.78 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.632 -172.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.714 ' HA ' ' HB ' ' A' ' 73' ' ' THR . 31.5 m -59.92 -59.45 5.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 174.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 60.2 -80.61 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.506 173.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -110.46 -36.07 5.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.422 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.411 ' NZ ' ' HB2' ' A' ' 71' ' ' LYS . 4.9 ttmp? -138.17 156.24 47.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -177.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.7 m -50.48 98.9 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.333 0.587 . . . . 0.0 111.358 179.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.714 ' HB ' ' HA ' ' A' ' 68' ' ' THR . 74.3 m -125.11 133.52 52.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.195 -0.911 . . . . 0.0 108.949 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.444 ' HA ' ' HD3' ' A' ' 75' ' ' PRO . 39.5 p -71.3 135.08 84.56 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-O 120.899 0.381 . . . . 0.0 111.012 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 74' ' ' THR . 31.6 Cg_exo -63.14 161.1 31.48 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.262 2.642 . . . . 0.0 111.997 178.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -136.15 165.76 24.97 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -174.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.1 p -129.86 104.09 7.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.009 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.519 ' HB3' HG13 ' A' ' 63' ' ' VAL . 26.9 t -82.23 100.19 9.73 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.543 ' HG2' HD12 ' A' ' 60' ' ' LEU . 7.3 tt0 -93.47 131.49 38.64 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.59 ' HB3' ' HG2' ' A' ' 61' ' ' GLU . 30.7 ttt-85 -126.35 150.44 48.55 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.868 HG11 HG11 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.48 144.21 16.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 118.979 0.809 . . . . 0.0 110.328 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.553 HD12 ' HB3' ' A' ' 59' ' ' LEU . 15.7 mt -101.62 149.64 23.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.872 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 83' ' ' LEU . 6.2 mp -83.26 172.31 12.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.599 171.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -48.02 -48.98 32.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.221 0.534 . . . . 0.0 110.983 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -119.52 38.84 3.76 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.17 -176.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 87' ' ' CYS . 7.1 tp10 -71.01 -21.83 62.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.986 0.422 . . . . 0.0 109.923 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.65 ' HB2' HE21 ' A' ' 90' ' ' GLN . 43.8 m 76.14 125.22 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.962 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.554 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.2 t -76.39 -39.41 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.078 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -72.88 -33.93 66.36 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.65 HE21 ' HB2' ' A' ' 87' ' ' CYS . 14.9 mt-30 -67.11 -30.05 69.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.958 174.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.66 -42.58 50.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.342 0.591 . . . . 0.0 110.397 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -56.78 -37.67 71.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.742 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 71.7 p -72.39 -13.9 61.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.818 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -78.1 -27.73 48.49 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 110.588 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.489 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.1 m0 -55.69 139.24 45.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -166.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.537 ' HB2' ' HD3' ' A' ' 65' ' ' LYS . 88.8 mttt -109.59 14.12 23.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.787 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -171.84 176.13 45.04 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.747 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.69 99.08 10.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.692 0.746 . . . . 0.0 110.857 -177.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.651 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.97 -148.8 15.32 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.963 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.7 mptp? -150.15 155.61 40.11 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.744 ' HB3' HD21 ' A' ' 59' ' ' LEU . 99.2 m-85 -84.58 120.78 26.75 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 169.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.584 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -102.07 127.37 55.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 121.846 -0.534 . . . . 0.0 110.356 -174.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.427 HD12 HD13 ' A' ' 35' ' ' ILE . 8.9 tp -81.19 120.87 25.42 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.736 ' HD2' HG23 ' A' ' 109' ' ' VAL . 19.3 ttmm -140.63 175.64 9.44 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.563 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.2 mp -98.47 156.47 16.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HB3' HG13 ' A' ' 58' ' ' VAL . 19.2 ptmt -91.36 -5.91 53.78 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.092 0.949 . . . . 0.0 110.245 178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -91.25 -3.41 56.93 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.747 166.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -108.72 -40.26 5.12 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 175.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.868 HG11 HG11 ' A' ' 81' ' ' VAL . 51.2 t -86.12 93.6 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.371 166.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.78 -176.14 5.02 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 176.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.28 45.24 0.74 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.408 0.623 . . . . 0.0 109.842 176.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 46.2 m -69.35 118.7 12.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.536 -174.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -75.54 115.82 15.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.598 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 66.44 -70.12 0.11 Allowed 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.93 0.769 . . . . 0.0 110.76 -173.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -164.55 134.51 3.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.611 0.243 . . . . 0.0 110.556 175.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm . . . . . 0 N--CA 1.466 0.354 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.246 -179.231 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.5 m . . . . . 0 N--CA 1.477 0.925 0 CA-C-O 120.815 0.34 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.7 p -159.18 149.31 19.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.386 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -82.16 -28.8 31.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.385 0.612 . . . . 0.0 109.594 175.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -81.23 157.34 25.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.291 177.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.8 tt0 -123.5 138.77 54.51 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.313 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.1 m -97.88 138.01 35.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.972 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.593 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 8.3 p90 -104.3 150.0 24.84 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -80.53 120.67 24.81 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.189 -174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.571 ' HB ' HG13 ' A' ' 23' ' ' ILE . 19.1 t -107.06 135.53 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.424 175.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.577 ' HB3' HD11 ' A' ' 20' ' ' LEU . 56.9 mt-30 -112.69 109.04 18.3 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 165.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.731 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -131.49 122.82 51.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.112 -175.461 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.581 ' CD2' HD13 ' A' ' 20' ' ' LEU . 42.3 m-70 -79.69 145.01 33.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.811 -176.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -123.34 167.79 13.34 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.093 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 31.2 m -79.4 -1.51 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.468 ' HB2' ' HB2' ' A' ' 46' ' ' TYR . 38.8 t -81.39 147.32 59.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.118 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -80.57 -173.16 1.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.173 2.582 . . . . 0.0 110.613 169.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 61.41 77.85 0.31 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -177.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 64.95 72.75 0.46 Allowed Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.616 -172.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.32 -31.07 53.44 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.014 2.476 . . . . 0.0 112.036 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.581 HD13 ' CD2' ' A' ' 12' ' ' HIS . 51.9 tp -81.94 99.91 9.36 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 173.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.8 m -75.19 109.51 8.74 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.278 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -94.73 115.75 34.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.571 HG13 ' HB ' ' A' ' 9' ' ' VAL . 1.6 pt -130.97 130.06 63.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.363 -177.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -84.5 96.05 9.0 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -107.28 162.15 20.69 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.336 -173.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.869 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.6 Cg_exo -65.29 144.76 81.75 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.747 1.631 . . . . 0.0 112.158 -171.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.593 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 18.7 mtp180 -60.22 -11.28 5.9 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.609 0.719 . . . . 0.0 110.214 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.87 -4.41 9.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.46 177.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.869 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.8 p -58.33 124.6 20.05 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.495 0.664 . . . . 0.0 110.777 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.56 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.7 t -106.06 177.88 4.73 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.261 172.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.708 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.63 -50.33 24.72 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 123.564 0.54 . . . . 0.0 111.938 -171.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.691 ' HA ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.44 -27.56 63.35 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.634 -176.385 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.88 -49.34 53.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.895 0.855 . . . . 0.0 109.158 178.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 31' ' ' ALA . 2.3 p -69.18 -27.65 35.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.941 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.752 HD13 ' HB2' ' A' ' 57' ' ' TYR . 12.2 mt -56.64 -57.69 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.459 170.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.533 ' HB2' ' HG3' ' A' ' 54' ' ' PRO . 36.3 tt0 -66.1 -32.19 73.5 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.866 -176.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -59.44 -45.91 90.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-O 121.373 0.606 . . . . 0.0 109.686 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.4 m -64.82 -39.59 93.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.081 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 7.2 mp -50.79 -43.79 58.77 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.063 0.459 . . . . 0.0 110.828 173.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 86.0 m -63.46 -43.95 95.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.749 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -79.64 -16.41 55.83 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.92 11.71 34.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.503 0.192 . . . . 0.0 111.089 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.884 ' HA ' HD21 ' A' ' 49' ' ' LEU . 37.1 ttmt -58.68 103.61 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.671 -177.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.51 ' HD2' ' HG2' ' A' ' 43' ' ' LYS . 98.1 m-85 59.95 21.12 10.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.538 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.3 m -77.88 -81.76 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.223 0.535 . . . . 0.0 109.894 174.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 15' ' ' SER . 37.4 t80 -95.27 6.9 47.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.417 -0.956 . . . . 0.0 108.417 174.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.1 t 62.34 65.23 0.88 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.45 -176.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.49 HG22 ' O ' ' A' ' 48' ' ' ILE . 48.8 mm -90.37 12.55 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.98 1.371 . . . . 0.0 108.222 173.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.884 HD21 ' HA ' ' A' ' 43' ' ' LYS . 1.5 mm? -91.9 10.19 29.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.334 -170.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.2 m -71.66 -28.58 63.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.074 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.437 ' HB2' ' CE1' ' A' ' 57' ' ' TYR . 18.7 m120 -131.34 91.58 34.72 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.42 5.62 4.56 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.217 1.945 . . . . 0.0 112.717 -176.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.434 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 25.5 p-10 -108.94 132.3 21.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.658 ' HB2' ' HB2' ' A' ' 32' ' ' GLN . 3.4 Cg_exo -76.21 18.35 0.67 Allowed 'Trans proline' 0 CA--C 1.528 0.189 0 C-N-CA 123.167 2.578 . . . . 0.0 112.493 -178.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.6 m -90.21 -38.31 13.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.343 -173.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.522 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 3.0 m-20 -88.48 2.77 52.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.95 -176.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.752 ' HB2' HD13 ' A' ' 35' ' ' ILE . 16.4 m-85 -104.54 175.32 5.53 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.352 0.596 . . . . 0.0 110.189 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.505 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -144.28 180.0 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.339 169.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 1.081 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.7 tm? -144.19 137.51 27.45 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 -176.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.639 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.49 127.33 46.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.82 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.609 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 15.2 pt-20 -93.21 84.24 4.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.476 1.132 . . . . 0.0 108.549 169.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.627 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 7.3 tt0 -86.0 123.35 31.23 Favored 'General case' 0 N--CA 1.426 -1.659 0 O-C-N 121.624 -0.672 . . . . 0.0 109.956 176.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.532 HG22 ' HG2' ' A' ' 65' ' ' LYS . 0.2 OUTLIER -113.77 116.13 51.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.647 HG23 ' HA2' ' A' ' 99' ' ' GLY . 97.4 t -70.9 106.98 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.29 0.567 . . . . 0.0 110.601 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.532 ' HG2' HG22 ' A' ' 63' ' ' VAL . 23.6 mmmt -118.15 91.25 3.52 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.342 177.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.658 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 7.8 p-10 -58.5 172.87 0.44 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.729 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.8 t -95.38 103.79 15.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.171 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.8 m -65.52 -36.51 84.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.496 0.665 . . . . 0.0 109.9 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -97.17 -137.56 0.27 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -128.29 90.09 3.02 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.266 0.555 . . . . 0.0 112.073 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -102.71 -32.65 9.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.714 169.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -137.61 153.98 49.82 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.272 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 10.0 t -66.61 -29.12 69.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.133 0.492 . . . . 0.0 110.325 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.0 p -119.25 161.79 35.19 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.084 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -54.06 151.34 28.01 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.438 2.092 . . . . 0.0 111.929 172.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.658 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 22.4 pttp -120.46 151.83 38.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.152 0.501 . . . . 0.0 111.775 -169.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 50.4 m -114.87 124.45 51.76 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.771 -177.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.9 t -87.27 98.66 11.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.627 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 7.6 tt0 -97.7 131.67 44.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.726 -174.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.536 ' HD2' ' OE2' ' A' ' 61' ' ' GLU . 2.3 tmt_? -128.04 148.7 50.56 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.738 HG11 HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -107.63 133.77 51.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 118.665 0.666 . . . . 0.0 111.005 -177.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.669 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 9.3 mt -93.14 166.61 12.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.394 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.469 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.7 mp -95.49 -176.8 3.88 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 165.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -59.67 -32.61 70.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.41 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 6.3 pt20 -125.28 38.58 4.15 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -176.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.669 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 13.3 mm-40 -75.38 -12.7 60.31 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.019 171.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.62 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 63.6 m 68.95 121.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.445 0.64 . . . . 0.0 111.943 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.56 ' H ' ' HA ' ' A' ' 30' ' ' THR . 74.9 t -75.75 -39.79 39.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.183 -173.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -72.58 -38.22 67.94 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.62 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 12.1 mt-30 -58.27 -46.77 85.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.51 172.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.18 -46.84 87.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.729 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -60.56 -26.98 67.32 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.181 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 t -75.12 -20.71 59.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -77.13 -23.12 51.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.361 0.6 . . . . 0.0 110.311 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.45 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 43.7 m0 -60.47 133.37 56.03 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.427 -172.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -113.16 11.85 18.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.695 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -156.77 167.78 33.73 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 109.081 -1.608 . . . . 0.0 109.081 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.77 105.65 17.94 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 118.02 0.91 . . . . 0.0 110.702 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.647 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -110.52 -142.84 9.4 Favored Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.586 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 99' ' ' GLY . 0.0 OUTLIER -158.1 160.32 37.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.104 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 1.081 ' HB3' HD11 ' A' ' 59' ' ' LEU . 95.8 m-85 -89.35 151.87 21.83 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 169.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 3.9 mp -132.69 128.89 58.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 O-C-N 121.933 -0.479 . . . . 0.0 110.465 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.438 HD11 HG12 ' A' ' 35' ' ' ILE . 12.8 tp -84.1 136.8 33.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.578 ' HD2' HG23 ' A' ' 109' ' ' VAL . 22.1 ttmm -154.27 165.31 36.72 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -89.04 149.78 23.07 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 169.71 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 56' ' ' ASP . 13.2 ptmm? -78.17 -28.62 48.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.172 0.51 . . . . 0.0 109.947 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.29 -13.89 61.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.479 0.657 . . . . 0.0 109.731 172.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -100.17 -9.38 22.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.738 HG21 HG11 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -96.85 -16.74 7.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.674 -178.767 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 110' ' ' GLN . 4.0 pt20 -58.33 88.03 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 122.256 1.027 . . . . 0.0 112.114 -171.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -118.74 1.17 11.57 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.737 175.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.1 t -139.1 99.74 3.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.887 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 24.4 mmt85 66.75 -176.22 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.976 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -75.57 138.13 41.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.448 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -73.73 -31.72 63.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 -177.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 20.0 pttm . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.004 -178.934 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 120.999 0.428 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -89.84 26.17 1.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 47.08 58.62 4.64 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.339 -167.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 1.5 mp0 -21.64 109.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 O-C-N 125.364 1.665 . . . . 0.0 112.933 -178.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -103.68 132.11 50.24 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.056 -173.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 p -111.69 169.61 8.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.033 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.883 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 4.1 p90 -130.2 149.8 51.74 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.413 ' CZ ' ' HD3' ' A' ' 24' ' ' LYS . 68.4 m-85 -89.42 138.31 31.56 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.858 -177.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.514 HG22 ' CE2' ' A' ' 7' ' ' PHE . 0.8 OUTLIER -126.49 158.09 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.092 0.472 . . . . 0.0 109.888 176.265 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.513 ' HB2' HD11 ' A' ' 20' ' ' LEU . 5.2 pm0 -129.63 107.46 9.46 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 163.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -118.36 139.63 44.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.727 -174.692 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 -81.93 118.61 23.09 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.031 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -82.64 167.44 18.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.091 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.2 t -62.75 -36.58 76.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.104 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 p -71.2 122.53 87.29 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 111.308 -176.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.03 -170.05 0.85 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.415 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 73.16 -38.92 0.43 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.99 0.916 . . . . 0.0 111.236 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.512 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 5.9 tp60 -116.9 83.44 14.53 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 165.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -65.0 -53.16 0.93 Allowed 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 123.023 2.482 . . . . 0.0 112.673 -170.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.513 HD11 ' HB2' ' A' ' 10' ' ' GLN . 40.4 tp -90.89 116.97 29.12 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.054 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 27.8 m -95.96 106.85 19.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.768 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 52.8 t -85.08 120.64 35.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.2 pt -130.92 168.73 23.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 120.891 0.377 . . . . 0.0 110.783 -177.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.413 ' HD3' ' CZ ' ' A' ' 8' ' ' PHE . 18.7 ttpp -124.87 111.93 16.05 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -117.92 164.73 18.53 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.002 -175.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.697 ' HD2' ' OG ' ' A' ' 29' ' ' SER . 5.8 Cg_exo -68.23 143.91 60.67 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 122.203 1.936 . . . . 0.0 111.993 -179.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.883 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 44.7 mtp180 -64.81 -3.64 3.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.532 0.682 . . . . 0.0 110.449 -176.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.43 -7.9 11.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.697 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 0.8 OUTLIER -55.62 123.18 13.22 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 121.484 0.659 . . . . 0.0 111.875 174.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.615 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.2 t -100.47 178.91 4.6 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.96 170.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.532 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.34 -51.4 19.59 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.607 0.567 . . . . 0.0 111.238 -172.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.503 HE22 ' HB2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -61.89 -32.05 72.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -177.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.64 -52.19 16.41 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.787 0.803 . . . . 0.0 109.368 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.418 ' CG1' HD22 ' A' ' 59' ' ' LEU . 2.3 p -66.91 -29.29 45.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.064 -178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.891 HD13 ' HG ' ' A' ' 103' ' ' LEU . 5.7 mm -56.93 -58.39 5.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.086 172.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.449 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.2 tt0 -68.51 -32.04 71.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.699 -175.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 41' ' ' LYS . 6.3 tp60 -63.8 -37.4 87.25 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 120.985 0.422 . . . . 0.0 109.976 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 27.7 m -70.53 -36.03 73.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.88 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.9 mp -55.45 -36.57 66.7 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.445 0.641 . . . . 0.0 110.375 172.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.9 m -70.45 -38.58 74.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.105 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 75.1 mmtt -71.02 -28.09 64.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.788 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 6.74 47.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.557 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.476 ' HD2' ' HB2' ' A' ' 44' ' ' TYR . 6.0 tmmm? -59.95 121.57 12.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.912 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t80 78.29 -31.45 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.183 0.993 . . . . 0.0 110.99 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -63.41 117.32 6.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 176.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.7 t80 65.39 8.69 5.16 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.684 0.754 . . . . 0.0 109.671 -177.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.453 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 13.4 p 43.14 75.46 0.09 Allowed 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.421 -172.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.8 tt -85.8 7.78 2.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.686 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.912 HD21 ' HA ' ' A' ' 44' ' ' TYR . 1.1 mm? -70.91 -10.56 59.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.741 -171.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 m -70.23 -20.87 63.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 109.969 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -139.57 69.73 38.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.974 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -91.54 11.25 2.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.476 2.784 . . . . 0.0 112.618 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.441 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 0.3 OUTLIER -98.66 126.17 39.96 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.39 177.614 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.503 ' HB2' HE22 ' A' ' 32' ' ' GLN . 89.6 Cg_endo -93.51 2.04 3.32 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.052 2.502 . . . . 0.0 114.149 -173.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.9 t -71.39 -33.81 69.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.608 0.242 . . . . 0.0 111.328 -174.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.655 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 0.2 OUTLIER -82.6 7.02 15.79 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 0.0 111.565 -178.482 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.584 ' HB3' HD12 ' A' ' 35' ' ' ILE . 6.7 m-85 -106.77 137.9 43.94 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.227 -176.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.717 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.8 OUTLIER -118.83 165.71 13.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 165.827 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.511 HD11 ' HB3' ' A' ' 101' ' ' PHE . 13.9 tp -117.89 138.46 52.11 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.559 HD13 ' HA ' ' A' ' 81' ' ' VAL . 2.6 mm? -98.51 126.08 43.95 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.703 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 13.1 pt-20 -88.66 86.43 6.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.596 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 10.8 tt0 -86.98 121.93 30.12 Favored 'General case' 0 N--CA 1.423 -1.817 0 O-C-N 120.702 -1.249 . . . . 0.0 108.733 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.501 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.4 OUTLIER -106.03 115.84 48.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 CA-C-O 121.425 0.631 . . . . 0.0 109.366 174.742 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.72 HG23 ' HA2' ' A' ' 99' ' ' GLY . 53.4 t -85.49 98.41 6.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.217 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.416 ' HG3' ' HB2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -81.9 65.95 7.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.519 1.152 . . . . 0.0 108.644 174.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.4 ' HB2' HG12 ' A' ' 64' ' ' VAL . 1.9 t70 -75.72 146.76 39.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.955 -175.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.9 t -68.74 131.76 45.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.418 0.628 . . . . 0.0 111.403 -176.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 m -100.6 -4.12 29.14 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.513 0.673 . . . . 0.0 109.543 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -96.54 -173.75 2.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.527 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -146.54 78.66 1.51 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.227 0.537 . . . . 0.0 111.456 177.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -172.88 -51.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.48 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.1 t -148.25 174.64 11.79 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.645 -178.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m 71.26 107.08 0.06 Allowed 'General case' 0 C--N 1.333 -0.13 0 O-C-N 123.708 0.63 . . . . 0.0 110.529 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.9 p -84.46 160.11 57.33 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.739 -178.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.05 125.91 18.86 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.332 2.021 . . . . 0.0 111.496 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HB2' ' HG3' ' A' ' 65' ' ' LYS . 13.9 mmmm -118.9 144.08 46.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.929 -175.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 12.7 p -119.76 121.06 38.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.674 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.48 ' HB2' HG13 ' A' ' 63' ' ' VAL . 20.3 m -104.27 103.06 12.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.587 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 16.2 tt0 -95.77 130.78 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -175.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -132.06 131.38 42.37 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.559 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -88.92 137.18 21.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.446 -173.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.509 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 17.9 mt -97.37 159.96 14.61 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.707 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.628 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 7.7 mp -86.92 -169.63 2.71 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 165.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.11 -36.12 82.31 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.695 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.478 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 3.4 pt20 -125.11 44.6 2.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.628 ' CG ' ' H ' ' A' ' 83' ' ' LEU . 8.1 mm-40 -77.33 -9.66 58.97 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 122.174 -0.329 . . . . 0.0 110.875 172.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.684 ' HB3' ' HB2' ' A' ' 90' ' ' GLN . 16.7 t 74.41 129.32 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.088 0.955 . . . . 0.0 111.415 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.615 ' H ' ' HA ' ' A' ' 30' ' ' THR . 75.6 t -78.54 -46.85 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-O 121.132 0.491 . . . . 0.0 109.778 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -72.41 -41.4 66.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.505 -174.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.684 ' HB2' ' HB3' ' A' ' 87' ' ' CYS . 8.7 mm-40 -63.26 -45.0 93.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.658 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.99 -51.26 69.95 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 110.493 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -55.49 -36.51 66.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.125 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.5 t -72.25 -15.73 61.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.454 -177.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 90' ' ' GLN . 68.4 mmtt -90.9 -13.01 34.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.329 0.585 . . . . 0.0 110.737 -178.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 42.1 m0 -59.01 152.35 20.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.177 -174.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.489 ' H ' HG21 ' A' ' 63' ' ' VAL . 3.3 mppt? -109.05 15.79 23.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.422 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -179.91 176.38 47.41 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 114.618 -1.174 . . . . 0.0 110.603 -176.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.485 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -94.38 106.63 18.61 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 117.512 0.656 . . . . 0.0 110.925 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.72 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.89 -146.76 13.48 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.073 -177.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -149.39 137.66 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.559 ' HB2' HG12 ' A' ' 11' ' ' VAL . 98.0 m-85 -84.34 146.31 27.78 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 119.521 -0.872 . . . . 0.0 109.324 169.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 71.3 mt -135.61 129.61 49.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 O-C-N 122.079 -0.388 . . . . 0.0 111.587 -171.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.891 ' HG ' HD13 ' A' ' 35' ' ' ILE . 9.1 mp -79.61 107.93 12.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 110.009 174.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.527 ' HG2' HG23 ' A' ' 109' ' ' VAL . 32.2 ttpt -138.26 128.86 26.45 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.537 HD22 ' O ' ' A' ' 56' ' ' ASP . 19.3 mt -62.32 139.72 58.52 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.624 0.726 . . . . 0.0 112.895 -171.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.717 ' HB3' HG13 ' A' ' 58' ' ' VAL . 13.9 ptmm? -70.95 -30.02 66.21 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.481 179.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.461 ' OE1' ' HG3' ' A' ' 106' ' ' LYS . 7.4 mm-40 -69.99 -14.8 62.87 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -111.24 -21.67 11.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.542 175.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.535 ' HB ' ' HA ' ' A' ' 106' ' ' LYS . 1.1 t -79.08 -27.32 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.317 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 106' ' ' LYS . 8.4 mm-40 -52.3 91.24 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.812 0.815 . . . . 0.0 112.872 -173.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -139.66 11.99 2.5 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.179 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.5 m -67.26 105.4 1.73 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.339 -1.301 . . . . 0.0 111.079 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' A' ' 113' ' ' ARG . 17.8 mtp180 -128.72 -48.15 1.26 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.578 176.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.9 -65.02 1.02 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.046 -177.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -90.65 132.53 35.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.424 0.63 . . . . 0.0 110.063 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.759 -175.816 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 121.03 0.443 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 p 179.37 -160.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.53 -33.34 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -72.7 125.76 28.27 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.838 173.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.486 ' OE2' ' HD2' ' A' ' 27' ' ' ARG . 29.3 tt0 -104.82 141.12 37.07 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.21 -170.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.506 ' O ' ' HE2' ' A' ' 24' ' ' LYS . 11.5 m -91.01 133.33 35.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 168.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.832 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -97.35 149.15 22.42 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -176.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -80.15 123.8 28.22 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.012 -175.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HB ' HG13 ' A' ' 23' ' ' ILE . 4.8 t -110.38 137.62 41.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.296 178.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HB3' HD11 ' A' ' 20' ' ' LEU . 45.8 mt-30 -109.64 108.13 18.44 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 164.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.797 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -131.31 124.84 55.91 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 CA-C-O 121.03 0.443 . . . . 0.0 111.204 -174.655 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.548 ' HB2' HG13 ' A' ' 102' ' ' ILE . 78.2 m-70 -77.26 143.52 38.85 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.735 -175.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -135.48 170.22 16.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 169.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.492 ' CG2' HD11 ' A' ' 48' ' ' ILE . 10.4 m -86.24 -1.08 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-O 120.632 0.253 . . . . 0.0 111.584 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -62.48 128.89 92.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.984 0.421 . . . . 0.0 110.295 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.7 170.48 19.92 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.024 2.483 . . . . 0.0 113.011 -176.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 18' ' ' GLN . 11.8 tp10 61.43 94.2 0.04 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.927 -175.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 13.2 mm-40 66.33 76.52 0.29 Allowed Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.146 -170.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.21 -32.1 93.96 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.677 2.251 . . . . 0.0 111.195 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 10' ' ' GLN . 66.2 tp -80.8 106.45 12.81 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.618 174.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 30.2 m -81.62 109.8 16.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.929 -179.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -89.27 124.97 42.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.58 HG13 ' HB ' ' A' ' 9' ' ' VAL . 10.8 pt -137.94 175.19 9.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.033 0.445 . . . . 0.0 110.937 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HE2' ' O ' ' A' ' 6' ' ' SER . 46.3 tttt -125.14 97.94 5.45 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 171.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 158.89 33.0 Favored Pre-proline 0 C--O 1.216 -0.692 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.156 -176.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 4.2 Cg_exo -64.23 145.93 89.55 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 121.928 1.752 . . . . 0.0 112.673 -170.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 17.4 mtp180 -64.91 -1.72 2.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.492 0.663 . . . . 0.0 110.201 179.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.3 m -113.89 -4.16 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.907 175.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.862 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 89.4 p -58.89 129.33 41.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.237 0.541 . . . . 0.0 110.933 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.57 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.1 t -106.17 178.57 4.52 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.675 ' O ' HG13 ' A' ' 35' ' ' ILE . . . -47.78 -50.11 26.69 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.551 0.532 . . . . 0.0 111.805 -170.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -71.24 -27.78 63.71 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.529 -176.417 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.18 -52.16 37.61 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.989 0.899 . . . . 0.0 108.983 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.535 HG11 HG21 ' A' ' 88' ' ' VAL . 2.7 p -67.19 -27.93 40.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.97 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.832 HD13 ' HB2' ' A' ' 57' ' ' TYR . 10.6 mt -56.39 -58.27 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.631 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 27.7 tt0 -68.61 -32.02 71.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.043 -176.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -64.17 -39.26 93.63 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 176.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.8 m -71.02 -35.68 72.11 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.6 mp -52.58 -40.14 62.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.171 0.51 . . . . 0.0 110.441 171.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.8 t -69.49 -40.75 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.821 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.8 mmtm -76.47 -10.59 59.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.574 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -116.07 16.77 16.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.675 178.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.867 ' HA ' HD21 ' A' ' 49' ' ' LEU . 36.2 ttmt -62.45 110.15 1.58 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.237 -176.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.512 ' H ' ' CD2' ' A' ' 49' ' ' LEU . 32.8 m-85 70.7 -12.32 0.56 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.579 1.152 . . . . 0.0 112.142 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.4 m -54.72 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -178.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -99.05 6.78 46.45 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.42 ' C ' ' H ' ' A' ' 49' ' ' LEU . 30.3 t 57.45 42.72 24.16 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.275 -176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.492 HD11 ' CG2' ' A' ' 14' ' ' VAL . 22.5 mm -63.52 -9.6 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.832 171.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.867 HD21 ' HA ' ' A' ' 43' ' ' LYS . 1.3 mm? -73.24 9.51 1.25 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.102 -1.408 . . . . 0.0 111.557 -171.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -59.94 -32.41 70.77 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 173.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -120.55 86.01 39.0 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.78 7.05 3.34 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.275 1.983 . . . . 0.0 113.012 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.437 HD22 ' HB2' ' A' ' 55' ' ' SER . 5.7 p-10 -113.77 136.84 22.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.929 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.455 ' HB3' ' HB2' ' A' ' 36' ' ' GLN . 65.6 Cg_endo -75.61 7.51 3.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.122 2.548 . . . . 0.0 112.869 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.453 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 4.2 m -88.23 -13.2 41.62 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.864 -174.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.518 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 37.2 m-20 -109.94 15.02 22.87 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.082 0.468 . . . . 0.0 111.568 -176.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' ' 35' ' ' ILE . 12.0 m-85 -115.91 165.78 12.71 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.096 0.474 . . . . 0.0 109.746 176.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.598 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -137.59 136.7 46.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.577 168.494 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 1.044 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.6 tm? -97.28 138.52 34.63 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.735 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 2.5 mm? -100.01 128.85 46.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.398 -178.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 11.3 pt-20 -93.95 84.2 4.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.355 1.074 . . . . 0.0 108.576 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.648 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 7.9 tt0 -85.52 124.02 31.62 Favored 'General case' 0 N--CA 1.428 -1.572 0 O-C-N 121.541 -0.724 . . . . 0.0 109.791 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.543 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.67 115.82 50.22 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.825 174.551 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 86.1 t -67.72 112.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.332 0.587 . . . . 0.0 110.392 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.437 ' HG2' HG22 ' A' ' 63' ' ' VAL . 24.7 mmmt -123.12 95.13 4.49 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.788 -1.096 . . . . 0.0 108.973 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HA ' ' H ' ' A' ' 76' ' ' LYS . 6.8 p-10 -60.77 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.402 -175.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.8 t -122.93 114.32 20.28 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.389 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 m -69.61 -36.62 76.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.212 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -87.02 -152.37 0.19 Allowed 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 70' ' ' LYS . 48.3 mtpt -113.81 81.51 1.54 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.199 0.523 . . . . 0.0 110.975 173.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -104.76 -31.57 9.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.602 173.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.494 HG22 ' H ' ' A' ' 74' ' ' THR . 14.5 m -139.33 143.87 38.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.386 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -64.61 -19.73 65.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.0 111.215 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.494 ' H ' HG22 ' A' ' 72' ' ' THR . 7.3 p -137.8 160.42 64.84 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.859 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.7 133.61 45.03 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.277 1.985 . . . . 0.0 111.598 172.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.582 ' H ' ' HA ' ' A' ' 66' ' ' ASP . 21.3 pttp -112.87 164.92 12.82 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.61 -168.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 21.8 m -113.63 139.98 48.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.008 -177.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 t -102.55 99.36 9.38 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 171.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.611 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 5.1 tt0 -94.9 132.11 40.07 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -174.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.51 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 3.9 tmt_? -127.67 149.0 50.4 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.664 HG11 HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -108.61 134.83 49.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 118.609 0.64 . . . . 0.0 111.151 -177.219 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 6.4 mt -93.28 161.16 14.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.291 -177.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 86' ' ' GLU . 6.8 mp -94.55 179.69 5.18 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.72 -41.43 67.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.771 0.32 . . . . 0.0 111.271 -176.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.411 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 7.1 pt20 -121.87 51.24 1.35 Allowed 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.657 ' HB2' ' HB3' ' A' ' 82' ' ' LEU . 17.9 mm-40 -83.19 -12.4 56.93 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 121.19 -0.204 . . . . 0.0 110.887 170.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.641 ' CB ' ' HB2' ' A' ' 90' ' ' GLN . 99.9 m 68.02 121.52 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.502 0.721 . . . . 0.0 112.102 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.57 ' H ' ' HA ' ' A' ' 30' ' ' THR . 73.8 t -75.97 -39.38 37.11 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.356 -174.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -72.06 -34.79 69.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HB2' ' CB ' ' A' ' 87' ' ' CYS . 0.9 OUTLIER -63.25 -45.18 92.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.214 173.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.496 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -61.27 -46.69 89.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.806 177.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.54 -29.36 67.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.955 178.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -75.13 -17.67 60.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.989 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 79.0 mttt -81.95 -23.91 35.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.057 0.456 . . . . 0.0 110.528 178.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.482 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 40.7 m0 -56.01 131.22 46.79 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.128 0.966 . . . . 0.0 113.31 -168.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -105.3 7.76 33.54 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 113.839 -1.528 . . . . 0.0 109.667 -175.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.43 -125.75 1.23 Allowed Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.327 -1.306 . . . . 0.0 110.068 178.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -149.85 110.85 4.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 175.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.648 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -122.31 -142.93 6.36 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.698 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -153.04 159.35 42.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.899 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 1.044 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.1 m-85 -88.23 146.9 25.11 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 168.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.735 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 2.8 mp -126.97 126.44 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 121.707 -0.62 . . . . 0.0 110.764 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 35' ' ' ILE . 19.8 tp -85.14 115.19 22.79 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.232 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 105' ' ' LEU . 21.6 ttmm -130.41 163.47 26.85 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.545 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 0.9 OUTLIER -85.74 151.13 24.09 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 172.455 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.598 ' HB3' HG13 ' A' ' 58' ' ' VAL . 9.2 ptmm? -84.95 -19.69 31.77 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.552 0.691 . . . . 0.0 110.313 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.67 -13.43 60.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.562 168.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -103.15 -8.87 20.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.307 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.664 HG21 HG11 ' A' ' 81' ' ' VAL . 0.5 OUTLIER -101.21 7.72 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.08 176.434 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -50.73 89.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.037 -0.983 . . . . 0.0 113.529 -168.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -154.27 18.04 0.48 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.285 -1.325 . . . . 0.0 107.991 171.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.5 t -104.81 60.61 0.69 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.861 -172.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.421 ' HB2' ' H ' ' A' ' 114' ' ' GLU . 13.6 mmt180 60.31 -92.53 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.328 175.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.421 ' H ' ' HB2' ' A' ' 113' ' ' ARG . 8.6 tp10 -147.97 143.52 27.36 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -113.86 -39.83 3.9 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.932 0.396 . . . . 0.0 110.754 -176.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.5 pttp . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.198 -177.274 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.4 t . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m -140.06 130.04 24.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -79.03 -47.0 17.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.238 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -77.97 128.59 34.13 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 120.809 0.338 . . . . 0.0 110.645 175.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.87 116.52 31.38 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.533 0.683 . . . . 0.0 109.308 178.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.588 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 11.6 m -153.25 160.68 42.81 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.109 173.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.664 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 9.2 p90 -135.76 149.53 49.19 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -83.77 121.48 27.36 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.303 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' HG13 ' A' ' 23' ' ' ILE . 9.2 t -99.78 128.73 51.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.056 0.455 . . . . 0.0 110.38 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.55 ' HG3' HD11 ' A' ' 20' ' ' LEU . 8.7 tt0 -100.16 106.59 18.31 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 166.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.679 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -135.47 137.16 50.13 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.242 -176.383 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -93.19 -168.86 2.01 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.127 0.418 . . . . 0.0 112.127 -173.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 72.19 92.81 0.08 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 124.479 1.112 . . . . 0.0 111.148 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.469 HG13 ' N ' ' A' ' 15' ' ' SER . 6.8 p -159.11 -56.88 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.55 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.469 ' N ' HG13 ' A' ' 14' ' ' VAL . 7.2 p -162.15 156.85 19.25 Favored Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 122.309 -0.244 . . . . 0.0 110.457 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -64.57 -43.24 13.85 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.274 1.983 . . . . 0.0 111.731 176.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.13 131.98 34.73 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 170.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 57.99 75.16 0.56 Allowed Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -166.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -77.9 26.1 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.196 2.597 . . . . 0.0 112.116 -176.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.55 HD11 ' HG3' ' A' ' 10' ' ' GLN . 46.1 tp -147.13 133.47 19.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.626 -175.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.3 m -104.06 110.26 22.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.193 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.8 p -99.75 128.29 51.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.301 0.572 . . . . 0.0 109.637 173.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.555 HG13 ' HB ' ' A' ' 9' ' ' VAL . 9.1 pt -137.66 159.97 34.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.696 -178.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.588 ' HE3' ' HB2' ' A' ' 6' ' ' SER . 18.8 tttp -114.48 97.8 6.52 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.457 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -110.31 169.31 6.5 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.055 -170.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.88 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 2.5 Cg_endo -71.9 140.1 34.44 Favored 'Trans proline' 0 N--CA 1.443 -1.442 0 C-N-CA 121.48 1.453 . . . . 0.0 110.612 -176.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.664 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 98.9 mtt180 -57.72 -36.48 72.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.8 -13.94 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 CA-C-N 113.944 -1.48 . . . . 0.0 112.617 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.88 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 80.1 p -58.45 124.76 20.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.679 0.752 . . . . 0.0 110.757 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.552 ' HA ' ' H ' ' A' ' 88' ' ' VAL . 2.2 t -100.66 179.63 4.36 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.927 171.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.67 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.51 -50.39 23.55 Favored 'General case' 0 C--O 1.209 -1.068 0 O-C-N 123.422 0.451 . . . . 0.0 110.745 -174.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.418 ' O ' ' HB ' ' A' ' 35' ' ' ILE . 0.4 OUTLIER -59.69 -31.91 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -72.8 -53.35 11.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 122.168 0.985 . . . . 0.0 109.641 -176.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.682 HG11 HD22 ' A' ' 59' ' ' LEU . 2.6 p -65.42 -27.7 42.49 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.074 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.791 HD13 HD12 ' A' ' 103' ' ' LEU . 10.1 mm -56.74 -56.07 16.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.363 168.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.852 ' HA ' HD12 ' A' ' 39' ' ' LEU . 25.2 tp60 -59.98 -45.49 92.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.941 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -59.1 -39.17 81.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.649 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.505 ' HB ' HD13 ' A' ' 103' ' ' LEU . 29.5 m -69.02 -41.13 78.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.73 0.3 . . . . 0.0 110.293 176.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 36' ' ' GLN . 29.7 mt -56.8 -38.84 73.11 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 120.986 0.422 . . . . 0.0 110.308 175.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.03 -52.98 44.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.783 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -80.34 -9.26 59.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.432 ' HB1' ' HB3' ' A' ' 47' ' ' SER . . . -131.33 28.27 4.7 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.396 -0.19 . . . . 0.0 111.097 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.533 ' HG3' ' CD1' ' A' ' 44' ' ' TYR . 3.4 tppp? -47.09 -74.53 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.239 0.616 . . . . 0.0 111.626 -174.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.533 ' CD1' ' HG3' ' A' ' 43' ' ' LYS . 73.5 m-85 -130.13 36.8 3.97 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 172.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 72.6 m -71.42 36.49 0.06 Allowed 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.81 -1.541 . . . . 0.0 112.381 -178.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 15.3 t80 55.94 36.34 27.15 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -166.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.432 ' HB3' ' HB1' ' A' ' 42' ' ' ALA . 60.1 m -124.45 -88.16 0.61 Allowed 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.407 -168.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.422 HD13 ' HA ' ' A' ' 48' ' ' ILE . 15.9 mm -82.18 -76.62 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.679 -176.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.518 ' HA ' ' CD2' ' A' ' 44' ' ' TYR . 4.6 mp 65.15 -41.66 0.31 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.5 p -59.62 -76.73 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -177.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -116.2 112.0 42.16 Favored Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.668 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -78.6 -17.49 12.62 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.647 2.231 . . . . 0.0 110.982 173.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.475 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 8.0 p-10 -85.41 134.78 39.69 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.602 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 1.2 Cg_endo -81.92 -6.59 12.31 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.737 2.291 . . . . 0.0 112.798 -174.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.403 ' O ' ' HD2' ' A' ' 106' ' ' LYS . 14.0 m -67.01 -6.28 16.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -174.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.539 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.7 m-20 -118.39 19.52 13.37 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.522 -0.177 . . . . 0.0 110.522 176.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.632 ' HB3' HD12 ' A' ' 35' ' ' ILE . 49.5 m-85 -123.24 143.92 49.73 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.397 0.618 . . . . 0.0 111.799 -175.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.649 HG13 ' HB3' ' A' ' 106' ' ' LYS . 3.1 m -127.66 165.99 25.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.411 166.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.682 HD22 HG11 ' A' ' 34' ' ' VAL . 12.2 tp -112.59 152.02 29.38 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.911 ' HB2' ' HB ' ' A' ' 102' ' ' ILE . 0.6 OUTLIER -109.3 140.19 43.28 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.042 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.686 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.1 pt-20 -105.58 87.14 2.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.117 0.961 . . . . 0.0 109.096 170.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.645 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 3.1 tt0 -86.58 123.72 32.09 Favored 'General case' 0 N--CA 1.42 -1.939 0 O-C-N 121.19 -0.944 . . . . 0.0 109.376 173.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.552 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -111.82 117.59 55.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.578 HG23 ' HA2' ' A' ' 99' ' ' GLY . 92.7 t -65.61 101.66 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 CA-C-O 121.601 0.715 . . . . 0.0 109.313 176.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.65 89.59 3.07 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.216 -172.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -89.5 -171.74 3.33 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.622 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 69' ' ' ASN . 5.9 t -142.8 162.46 35.41 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.267 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.3 t -71.91 -26.14 62.19 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -174.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.454 ' O ' HG23 ' A' ' 67' ' ' THR . 4.2 p-10 -123.75 152.69 41.87 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 120.74 0.305 . . . . 0.0 111.014 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -139.18 85.93 2.1 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.66 0.743 . . . . 0.0 112.632 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.4 ' HE3' ' HB3' ' A' ' 71' ' ' LYS . 24.3 mmmt -113.52 -60.59 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.004 170.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -110.23 -22.06 11.94 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.65 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.424 ' HB ' HG21 ' A' ' 67' ' ' THR . 17.5 p -94.66 111.71 23.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.435 178.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.9 p -100.15 150.26 36.74 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.705 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.79 131.97 40.23 Favored 'Trans proline' 0 CA--C 1.509 -0.726 0 C-N-CA 122.551 2.168 . . . . 0.0 110.973 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -156.66 146.16 20.65 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.219 -161.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.2 m -87.42 135.02 33.5 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.418 0.627 . . . . 0.0 112.007 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.7 m -102.96 100.0 9.93 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.605 171.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.645 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 43.1 tt0 -94.33 132.69 38.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.942 -174.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.607 ' HB3' ' CG ' ' A' ' 61' ' ' GLU . 6.2 tpp180 -127.73 160.71 30.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.79 HG11 HG11 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -115.71 144.71 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 118.381 0.537 . . . . 0.0 110.474 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.666 HD21 ' HB3' ' A' ' 61' ' ' GLU . 20.8 mt -104.84 152.07 23.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.672 -174.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.415 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 7.3 mp -81.36 169.67 16.94 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 166.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -41.39 62.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.9 0.381 . . . . 0.0 111.389 -176.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.437 ' HA ' ' OG1' ' A' ' 30' ' ' THR . 14.1 pt20 -114.09 32.03 6.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.59 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 22.6 tp10 -63.39 -20.69 65.75 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.992 0.425 . . . . 0.0 110.331 175.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.619 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 73.9 m 72.09 122.27 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.208 178.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.552 ' H ' ' HA ' ' A' ' 30' ' ' THR . 90.9 t -75.27 -38.72 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.25 -171.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -72.92 -33.96 66.29 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.619 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 0.1 OUTLIER -65.43 -40.57 93.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.192 176.781 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.515 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -68.88 -40.32 79.32 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.687 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.63 -36.03 79.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.135 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -70.51 -15.36 62.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.545 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 88.6 mttt -75.55 -24.98 56.75 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.011 0.434 . . . . 0.0 110.434 177.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.443 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 45.1 m0 -63.68 153.95 34.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -167.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mtmm -135.81 24.99 3.37 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.176 -1.375 . . . . 0.0 108.205 175.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.479 ' O ' HG23 ' A' ' 63' ' ' VAL . . . -169.28 153.5 22.12 Favored Glycine 0 N--CA 1.44 -1.055 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.37 10.59 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.283 1.041 . . . . 0.0 111.062 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.578 ' HA2' HG23 ' A' ' 64' ' ' VAL . . . -106.38 -154.35 20.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.894 -176.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.436 ' HB2' ' HE3' ' A' ' 100' ' ' LYS . 1.3 mtmt -146.32 143.88 29.43 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.679 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 99.3 m-85 -80.42 153.06 28.5 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 169.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.911 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 92.9 mt -135.57 128.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 O-C-N 122.02 -0.425 . . . . 0.0 111.426 -173.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.791 HD12 HD13 ' A' ' 35' ' ' ILE . 3.4 tp -77.7 130.46 36.82 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 1.1 tppt? -151.61 175.79 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.568 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 8.7 mp -101.92 133.33 46.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.86 0.362 . . . . 0.0 110.416 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.649 ' HB3' HG13 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -63.52 -29.82 71.03 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.074 173.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -70.45 -22.28 62.71 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -100.63 -6.42 25.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.843 0.83 . . . . 0.0 108.898 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.79 HG11 HG11 ' A' ' 81' ' ' VAL . 69.9 t -124.08 31.63 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.899 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -77.99 65.51 3.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.624 -174.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.07 -9.26 34.24 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.195 -0.911 . . . . 0.0 108.916 172.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.9 m -57.56 132.32 52.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.868 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -164.12 -172.64 2.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.499 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 67.24 92.13 0.08 Allowed 'General case' 0 C--N 1.331 -0.21 0 O-C-N 124.009 0.818 . . . . 0.0 110.634 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.5 t70 70.84 155.15 0.14 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.496 -178.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.412 ' NZ ' ' HB3' ' A' ' 116' ' ' LYS . 6.8 ttpm? . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.624 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 120.814 0.34 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.485 ' HB3' ' OE2' ' A' ' 4' ' ' GLU . 45.4 m -127.73 105.29 8.35 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -101.72 8.82 41.41 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.52 -174.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.485 ' OE2' ' HB3' ' A' ' 2' ' ' SER . 6.7 pm0 -75.44 163.26 27.6 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.554 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 0.2 OUTLIER -102.89 133.47 47.92 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.189 0.519 . . . . 0.0 110.617 -172.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.7 p -118.75 139.8 50.97 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.219 0.533 . . . . 0.0 111.187 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.869 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 5.9 p90 -124.14 156.7 36.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.46 ' CZ ' ' HE2' ' A' ' 24' ' ' LYS . 43.7 m-85 -84.75 125.22 32.36 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.22 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.6 ' HB ' HG13 ' A' ' 23' ' ' ILE . 3.9 t -113.76 129.32 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.457 178.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.626 ' HB3' HD11 ' A' ' 20' ' ' LEU . 44.9 mt-30 -97.96 108.54 21.28 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 164.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.787 ' HA ' ' O ' ' A' ' 101' ' ' PHE . 0.1 OUTLIER -120.08 115.19 46.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-O 121.51 0.672 . . . . 0.0 110.406 177.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.63 ' CD2' HD13 ' A' ' 20' ' ' LEU . 9.4 m-70 -87.67 168.21 13.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.266 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.676 ' HB3' ' CE1' ' A' ' 46' ' ' TYR . 28.4 t70 -142.95 168.79 18.87 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 166.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -78.45 -22.58 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.931 0.396 . . . . 0.0 111.145 -176.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.969 ' HB2' ' HD1' ' A' ' 46' ' ' TYR . 12.7 m -65.14 148.49 97.84 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.821 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 -28.54 8.47 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.734 2.289 . . . . 0.0 113.826 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.74 113.16 7.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.287 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 60.26 79.7 0.28 Allowed Pre-proline 0 C--O 1.225 -0.234 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.836 -174.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -52.63 -44.59 46.44 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.336 2.024 . . . . 0.0 111.914 -177.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.63 HD13 ' CD2' ' A' ' 12' ' ' HIS . 27.0 tp -116.58 121.15 40.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.489 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 2.6 m -92.06 109.45 20.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 173.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 50.0 t -95.81 110.69 24.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.6 HG13 ' HB ' ' A' ' 9' ' ' VAL . 11.2 pt -116.68 168.28 8.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.891 0.377 . . . . 0.0 110.706 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HE2' ' CZ ' ' A' ' 8' ' ' PHE . 19.0 tttm -117.1 96.05 5.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 169.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB1' ' CD ' ' A' ' 26' ' ' PRO . . . -100.47 167.49 10.82 Favored Pre-proline 0 CA--C 1.506 -0.712 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.461 -175.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.887 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 5.6 Cg_exo -68.74 141.98 51.27 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 121.535 1.49 . . . . 0.0 111.523 -177.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.869 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 35.5 mtp180 -66.33 -0.45 2.64 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.601 0.715 . . . . 0.0 109.966 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.415 ' H ' ' C ' ' A' ' 26' ' ' PRO . 33.5 m -114.12 -2.44 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.461 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.887 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 91.2 p -59.86 119.69 8.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.277 0.561 . . . . 0.0 109.859 175.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.496 ' C ' HG23 ' A' ' 88' ' ' VAL . 17.8 p -94.15 -173.82 3.21 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -55.8 -49.92 71.89 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.711 -176.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.43 HE21 ' C ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -61.92 -30.71 71.08 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -178.817 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -70.68 -53.74 14.54 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.485 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 31' ' ' ALA . 2.2 p -66.59 -27.6 40.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 113.599 -1.637 . . . . 0.0 110.135 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 31' ' ' ALA . 4.3 mm -55.88 -58.15 5.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.584 174.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.558 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 54.7 mt-30 -73.28 -32.77 64.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.752 0.31 . . . . 0.0 110.894 -175.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -60.99 -37.3 81.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-O 120.775 0.322 . . . . 0.0 110.216 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.609 ' HA ' ' HB3' ' A' ' 41' ' ' LYS . 32.6 m -75.68 -30.18 59.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.272 175.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 5.9 mp -55.68 -47.93 75.91 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-O 120.961 0.41 . . . . 0.0 109.943 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 56.8 m -67.16 -37.21 83.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.542 0.687 . . . . 0.0 110.161 176.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.609 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 27.9 tptp -69.86 -10.28 57.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.069 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.806 ' HA ' ' HB2' ' A' ' 45' ' ' SER . . . -124.56 12.95 8.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.262 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.451 ' HE2' ' CE2' ' A' ' 44' ' ' TYR . 6.9 ttpm? -46.21 -41.89 13.42 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.993 0.808 . . . . 0.0 111.467 -173.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.451 ' CE2' ' HE2' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -136.92 -1.61 2.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.136 0.494 . . . . 0.0 110.078 168.532 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.806 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 20.6 m -64.09 -68.15 0.37 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.937 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.969 ' HD1' ' HB2' ' A' ' 15' ' ' SER . 97.6 m-85 -86.24 13.27 8.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.8 p 45.26 57.29 4.91 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.027 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.518 HD13 ' HA ' ' A' ' 39' ' ' LEU . 7.2 tt -78.96 9.2 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.764 -175.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.703 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.3 mp -56.39 -23.27 36.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.636 -175.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.6 m -65.53 -34.33 78.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.193 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -128.81 90.62 45.47 Favored Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 120.956 0.408 . . . . 0.0 111.003 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -84.56 7.44 5.18 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.653 2.235 . . . . 0.0 111.977 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.464 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 32.8 m-20 -112.55 146.53 35.17 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.135 -176.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 53' ' ' ASN . 26.4 Cg_endo -94.18 1.65 3.01 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.619 2.879 . . . . 0.0 112.283 -177.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.418 ' O ' ' HD2' ' A' ' 106' ' ' LYS . 2.6 p -77.64 -16.98 58.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.959 -173.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.14 3.96 39.05 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.849 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.539 ' HB3' HD12 ' A' ' 35' ' ' ILE . 20.8 m-85 -118.54 134.45 55.08 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.259 0.552 . . . . 0.0 112.149 -171.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.87 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.4 OUTLIER -108.69 178.8 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.445 163.158 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 1.108 HD11 ' HB3' ' A' ' 101' ' ' PHE . 3.0 tm? -131.04 132.84 45.21 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 81' ' ' VAL . 1.7 mm? -98.83 125.97 44.35 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.546 -175.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 9.0 pt-20 -88.74 86.0 6.89 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.36 1.076 . . . . 0.0 108.508 170.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.607 ' O ' ' HA3' ' A' ' 99' ' ' GLY . 17.9 tt0 -85.53 122.66 29.98 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.525 -0.735 . . . . 0.0 109.145 175.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.566 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.3 OUTLIER -115.61 117.92 57.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 121.449 0.642 . . . . 0.0 110.08 176.194 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.554 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 59.3 t -83.84 103.92 11.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.016 -175.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -92.7 88.12 6.15 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.503 174.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -66.37 149.34 50.54 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.494 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -114.32 139.86 49.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.134 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.4 m -76.63 -32.08 57.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.17 -178.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -100.72 -96.47 0.26 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.06 110.93 22.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.06 0.457 . . . . 0.0 112.065 -168.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.618 ' HD2' ' H ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -117.55 162.47 17.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.731 175.934 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.12 -46.72 40.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.314 0.578 . . . . 0.0 110.667 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.0 t -167.44 -35.15 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.991 175.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -132.01 164.8 40.54 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.89 176.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -53.01 145.51 41.21 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.694 2.263 . . . . 0.0 112.354 174.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 76' ' ' LYS . 57.3 mmtt -81.24 128.87 34.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.587 -176.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 6.8 p -109.05 107.4 17.72 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.485 -179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.1 m -82.16 104.93 12.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.489 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.572 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 18.5 tt0 -94.34 131.21 40.21 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -176.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.521 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 29.4 ttt180 -126.68 149.85 49.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.548 ' HA ' HD13 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -105.8 139.5 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.822 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.685 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 23.6 mt -96.86 156.89 16.15 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.306 0.574 . . . . 0.0 111.578 -176.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.525 ' H ' ' HB2' ' A' ' 86' ' ' GLU . 47.2 mt -76.98 168.45 20.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 162.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.16 -40.13 64.08 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -120.73 35.69 4.8 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.695 0.283 . . . . 0.0 111.669 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.685 ' HB3' ' HB3' ' A' ' 82' ' ' LEU . 23.9 tp10 -65.57 -17.68 64.76 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.638 ' HB2' HE21 ' A' ' 90' ' ' GLN . 18.9 m 78.2 109.48 0.07 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.521 176.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.496 HG23 ' C ' ' A' ' 30' ' ' THR . 86.8 t -55.71 -45.84 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.332 173.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -73.72 -35.54 65.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.66 -175.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.638 HE21 ' HB2' ' A' ' 87' ' ' CYS . 18.1 mt-30 -62.31 -45.37 93.56 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 173.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.24 90.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.677 177.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -54.41 -47.35 72.86 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.81 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.7 t -75.29 -4.44 39.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 0.0 110.466 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -99.35 -6.69 27.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.963 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.508 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 42.2 m0 -72.59 161.12 31.19 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.724 0.773 . . . . 0.0 112.541 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -128.77 21.59 5.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.02 178.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -178.0 169.59 41.5 Favored Glycine 0 N--CA 1.44 -1.078 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.248 -178.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.466 ' O ' ' HB ' ' A' ' 64' ' ' VAL . . . -88.58 102.96 15.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 117.347 0.574 . . . . 0.0 111.376 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.607 ' HA3' ' O ' ' A' ' 62' ' ' GLU . . . -111.09 -149.18 11.57 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.422 -0.894 . . . . 0.0 111.898 177.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 1.4 mptp? -152.61 155.01 36.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 1.108 ' HB3' HD11 ' A' ' 59' ' ' LEU . 99.4 m-85 -86.91 116.73 25.17 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 173.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.595 HG13 ' HB2' ' A' ' 12' ' ' HIS . 1.7 mp -101.46 122.91 54.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 O-C-N 122.013 -0.429 . . . . 0.0 110.365 -173.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.506 ' CD1' HD13 ' A' ' 35' ' ' ILE . 7.5 tp -74.2 135.52 42.77 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.84 ' HD2' HG23 ' A' ' 109' ' ' VAL . 22.6 ttmm -160.81 149.39 16.41 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.624 -179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.533 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 10.9 mp -70.39 141.68 52.15 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.204 174.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.87 ' HB3' HG13 ' A' ' 58' ' ' VAL . 14.3 ptpt -72.64 -31.04 64.81 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.907 -179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -72.83 -17.07 61.59 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 177.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -108.28 5.84 26.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.633 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.84 HG23 ' HD2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -108.4 -12.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.606 -178.508 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -60.81 83.44 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 122.028 0.918 . . . . 0.0 112.467 -168.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -101.14 -4.98 26.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.053 177.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.3 t -119.7 120.82 37.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.068 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 51.9 ttm-85 58.77 71.35 0.59 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.554 0.692 . . . . 0.0 110.665 -176.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' ' 114' ' ' GLU . 0.4 OUTLIER -100.02 -0.03 40.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.546 176.423 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -77.32 82.18 3.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.793 178.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--N 1.324 -0.514 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.092 -175.776 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.477 0.892 0 CA-C-O 121.177 0.513 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.407 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 32.4 m -128.63 125.19 37.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.584 -175.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.8 -21.69 43.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.486 0.66 . . . . 0.0 109.563 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.407 ' O ' ' HB3' ' A' ' 2' ' ' SER . 16.2 pt-20 -137.22 172.47 12.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.933 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.66 109.03 20.57 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 171.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -144.56 160.74 40.64 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.677 -177.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.531 ' HB3' ' HG2' ' A' ' 27' ' ' ARG . 6.0 p90 -147.87 155.46 41.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.5 ' CZ ' ' HD2' ' A' ' 24' ' ' LYS . 65.7 m-85 -87.08 129.61 34.84 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.188 -175.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.583 ' HB ' HG13 ' A' ' 23' ' ' ILE . 22.1 t -109.09 131.34 60.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.087 0.47 . . . . 0.0 110.767 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HG2' ' HG2' ' A' ' 100' ' ' LYS . 28.2 tt0 -101.57 106.49 17.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 166.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.626 ' HB ' ' HB2' ' A' ' 101' ' ' PHE . 1.8 p -139.57 137.89 39.82 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-O 120.883 0.373 . . . . 0.0 111.337 -172.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.596 ' NE2' ' HD2' ' A' ' 100' ' ' LYS . 94.0 m-70 -95.39 150.39 20.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 177.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.512 ' O ' ' HB ' ' A' ' 14' ' ' VAL . 8.5 p-10 -97.42 -70.39 0.72 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.512 ' HB ' ' O ' ' A' ' 13' ' ' ASP . 9.3 p 171.42 -23.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.319 0 C-N-CA 122.996 0.518 . . . . 0.0 110.564 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.1 m -75.84 156.76 84.37 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.672 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -89.5 -159.79 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 123.162 2.575 . . . . 0.0 112.02 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 66.29 -75.24 0.06 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.237 0.615 . . . . 0.0 110.712 -176.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.468 ' HB2' ' OH ' ' A' ' 46' ' ' TYR . 15.8 mm100 -114.56 82.3 7.72 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 170.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -76.5 -10.19 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.289 2.659 . . . . 0.0 113.332 -169.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp -110.33 126.23 54.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.975 0.417 . . . . 0.0 110.996 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 11' ' ' VAL . 87.8 m -98.24 121.15 39.82 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.05 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.1 t -110.82 111.33 35.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.001 0.429 . . . . 0.0 109.846 176.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.583 HG13 ' HB ' ' A' ' 9' ' ' VAL . 2.5 pt -124.12 159.83 29.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.298 -178.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HD2' ' CZ ' ' A' ' 8' ' ' PHE . 1.4 ttpm? -109.95 96.55 6.31 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 171.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.69 163.67 18.03 Favored Pre-proline 0 CA--C 1.504 -0.82 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.929 -175.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.984 ' HD2' ' HB3' ' A' ' 29' ' ' SER . 6.3 Cg_exo -68.42 145.91 66.69 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.704 1.603 . . . . 0.0 110.974 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.531 ' HG2' ' HB3' ' A' ' 7' ' ' PHE . 73.6 mtt180 -62.02 -15.69 46.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.781 0.801 . . . . 0.0 109.634 -178.165 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.3 m -98.13 -4.59 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.3 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.984 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 93.7 p -55.72 123.25 13.52 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.786 0.803 . . . . 0.0 110.476 178.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.546 ' HB ' ' HA ' ' A' ' 87' ' ' CYS . 1.0 OUTLIER -103.53 174.61 5.79 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.991 173.246 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 35' ' ' ILE . . . -47.15 -51.19 18.85 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 123.522 0.514 . . . . 0.0 111.331 -173.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.862 HE22 ' HB2' ' A' ' 54' ' ' PRO . 15.2 tp60 -60.92 -31.6 71.12 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.463 -178.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -78.76 -51.86 9.19 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 -177.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.447 HG11 HG21 ' A' ' 88' ' ' VAL . 2.9 p -60.55 -28.54 42.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.765 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.655 HD13 ' HG ' ' A' ' 103' ' ' LEU . 5.8 mm -56.45 -57.86 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.052 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.524 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 28.4 tt0 -70.76 -32.37 69.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.201 -174.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.402 HE22 ' HD3' ' A' ' 26' ' ' PRO . 28.1 tt0 -60.87 -38.01 84.11 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.978 0.418 . . . . 0.0 110.251 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.5 m -71.01 -31.92 68.56 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.078 175.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 36' ' ' GLN . 6.5 mp -62.42 -33.7 75.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.409 0.623 . . . . 0.0 110.806 173.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t -78.24 -36.74 46.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.812 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -70.98 -50.33 35.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.216 0.531 . . . . 0.0 110.179 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.785 ' HA ' ' HB2' ' A' ' 45' ' ' SER . . . -113.88 80.78 1.43 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.023 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.724 ' O ' HD12 ' A' ' 49' ' ' LEU . 37.4 ttmt -87.64 -80.8 0.25 Allowed 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 171.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.87 -18.07 48.54 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.785 ' HB2' ' HA ' ' A' ' 42' ' ' ALA . 42.5 m -62.0 113.8 3.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.316 171.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.468 ' OH ' ' HB2' ' A' ' 18' ' ' GLN . 29.1 m-85 64.98 2.93 1.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.647 0.592 . . . . 0.0 110.823 -175.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.1 t 48.9 75.13 0.15 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.913 0.863 . . . . 0.0 111.639 -174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.639 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 41.6 mm -97.59 -9.18 9.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.054 -0.975 . . . . 0.0 109.16 175.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.724 HD12 ' O ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.99 10.15 1.6 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.822 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 p -55.19 -37.36 66.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-O 121.609 0.718 . . . . 0.0 109.113 172.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.467 ' HB2' ' HE1' ' A' ' 57' ' ' TYR . 17.2 m120 -120.62 90.56 46.12 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.351 167.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -73.25 -11.75 25.08 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.608 2.205 . . . . 0.0 112.598 -172.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.21 125.03 39.28 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-O 121.328 0.585 . . . . 0.0 109.915 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.862 ' HB2' HE22 ' A' ' 32' ' ' GLN . 81.2 Cg_endo -76.7 -3.23 13.55 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.832 2.354 . . . . 0.0 112.831 -173.012 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.571 ' O ' ' HD3' ' A' ' 106' ' ' LYS . 14.8 m -76.95 0.32 21.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.701 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 106' ' ' LYS . 8.1 m-20 -108.11 0.49 21.67 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.025 0.441 . . . . 0.0 110.275 174.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.596 ' HA ' ' HA ' ' A' ' 105' ' ' LEU . 47.0 m-85 -107.62 156.52 18.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.093 -177.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.669 HG13 ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -135.38 169.21 21.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 167.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 1.07 HD11 ' HB3' ' A' ' 101' ' ' PHE . 1.5 tm? -123.0 139.62 53.89 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -174.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.641 HD13 HG13 ' A' ' 81' ' ' VAL . 1.0 OUTLIER -103.11 128.63 49.96 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.017 -177.207 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.7 ' HG3' ' HB3' ' A' ' 80' ' ' ARG . 9.4 pt-20 -92.94 87.3 5.73 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.037 0.922 . . . . 0.0 108.96 171.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 79' ' ' GLN . 9.7 tt0 -85.7 123.3 30.93 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.573 ' HA ' ' HA3' ' A' ' 99' ' ' GLY . 0.2 OUTLIER -116.37 116.66 52.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.589 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 57.6 t -76.86 98.42 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.309 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.511 ' HD3' ' HD3' ' A' ' 96' ' ' LYS . 10.2 mtmp? -82.41 82.09 8.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 172.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.556 ' HB2' ' HB3' ' A' ' 75' ' ' PRO . 3.2 p30 -71.16 179.95 2.61 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.987 -1.006 . . . . 0.0 112.37 -169.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 m -133.38 92.27 2.98 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 113.923 -1.49 . . . . 0.0 109.715 -174.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 40.1 m -72.79 93.83 1.72 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.889 178.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.475 HD22 ' N ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -148.33 178.08 8.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.787 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -123.47 61.48 1.05 Allowed 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.148 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 71' ' ' LYS . 26.2 mmtp -137.64 -175.29 4.02 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.945 172.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.1 m -77.54 -11.65 59.88 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.992 0.425 . . . . 0.0 110.706 -179.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.64 114.74 4.61 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.939 176.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.8 p -89.37 163.21 34.54 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.708 -175.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.556 ' HB3' ' HB2' ' A' ' 66' ' ' ASP . 25.2 Cg_exo -63.57 159.75 39.3 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.909 2.406 . . . . 0.0 111.811 174.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.73 128.67 47.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.233 0.54 . . . . 0.0 112.025 -171.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' A' ' 64' ' ' VAL . 19.8 m -93.4 115.26 27.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.442 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 m -92.97 103.9 16.18 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 62' ' ' GLU . 9.2 tt0 -94.85 131.29 40.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.892 0.377 . . . . 0.0 110.217 -174.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.7 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 38.8 ttm180 -127.2 158.12 37.96 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.668 HG11 HG11 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -112.62 144.36 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 118.355 0.525 . . . . 0.0 110.819 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 86' ' ' GLU . 19.8 mt -100.01 -177.07 3.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.31 0.576 . . . . 0.0 111.524 -176.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.794 ' H ' ' HB3' ' A' ' 86' ' ' GLU . 17.1 mt -117.62 -170.83 1.94 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.962 -179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.44 -30.66 71.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.164 0.507 . . . . 0.0 109.874 175.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.69 19.78 5.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -177.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.794 ' HB3' ' H ' ' A' ' 83' ' ' LEU . 13.7 tp10 -79.27 80.82 5.6 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 123.085 1.421 . . . . 0.0 107.771 169.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 90' ' ' GLN . 58.1 m -35.63 135.45 0.28 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-N 110.257 -3.156 . . . . 0.0 113.68 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.535 ' H ' ' HA ' ' A' ' 30' ' ' THR . 55.3 t -76.16 -41.47 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.468 -175.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -72.44 -33.99 67.46 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.657 ' HB2' ' HB2' ' A' ' 87' ' ' CYS . 1.6 mt-30 -64.37 -42.19 96.3 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.299 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.549 ' HA ' ' HE3' ' A' ' 94' ' ' LYS . . . -63.19 -45.75 90.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.681 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -59.63 -29.72 68.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.693 -178.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.1 p -76.95 -20.69 55.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.343 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.549 ' HE3' ' HA ' ' A' ' 91' ' ' ALA . 75.1 mttt -73.02 -30.0 63.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.37 0.605 . . . . 0.0 110.209 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.485 ' HE1' ' HB2' ' A' ' 61' ' ' GLU . 39.3 m0 -49.09 128.84 17.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.872 -167.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.542 ' H ' HG21 ' A' ' 63' ' ' VAL . 22.4 mtpp -97.21 20.11 11.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.043 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 179.16 -171.56 43.55 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.595 -177.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -103.14 111.25 23.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.772 0.786 . . . . 0.0 110.768 178.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.573 ' HA3' ' HA ' ' A' ' 63' ' ' VAL . . . -116.45 -149.28 9.2 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.12 -177.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.688 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 2.0 mtmt -151.11 145.53 25.53 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 1.07 ' HB3' HD11 ' A' ' 59' ' ' LEU . 98.0 m-85 -79.2 154.22 29.41 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 60' ' ' LEU . 67.3 mt -142.93 129.62 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 O-C-N 121.679 -0.638 . . . . 0.0 111.65 -174.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.655 ' HG ' HD13 ' A' ' 35' ' ' ILE . 5.8 mp -73.36 141.54 47.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.902 0.382 . . . . 0.0 110.98 176.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.487 ' HG3' ' H ' ' A' ' 105' ' ' LEU . 9.3 tppt? -154.06 176.29 12.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.596 ' HA ' ' HA ' ' A' ' 57' ' ' TYR . 5.0 mp -101.28 142.57 32.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.164 0.507 . . . . 0.0 110.05 174.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.669 ' HB3' HG13 ' A' ' 58' ' ' VAL . 16.9 ptmt -82.07 -21.7 36.72 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.008 -177.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -70.3 -23.76 62.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.836 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 4.0 pt20 -101.35 -26.99 13.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.077 0.465 . . . . 0.0 109.857 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.668 HG11 HG11 ' A' ' 81' ' ' VAL . 6.8 t -75.8 -51.21 21.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.258 176.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.619 ' OE1' ' HA ' ' A' ' 115' ' ' ASP . 4.1 pt20 40.61 31.1 0.1 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 174.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.477 ' H ' HG12 ' A' ' 109' ' ' VAL . . . 58.13 18.43 5.27 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 177.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -133.47 168.93 17.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.959 0.409 . . . . 0.0 110.325 -178.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -94.56 -5.21 46.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -141.3 -179.61 6.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.876 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.619 ' HA ' ' OE1' ' A' ' 110' ' ' GLN . 2.8 p-10 -88.97 -25.33 22.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.756 0.312 . . . . 0.0 110.947 -178.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.5 tptt . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.608 -177.773 . . . . . . . . 0 0 . 1 stop_ save_